SCHEMBL6156438

SCHEMBL6156438

N#Cc1cccc(Nc2ccccc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
MAPT P10636 5/20 0.61
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
AR P10275 1/20 0.60
KCNA5 P22460 1/20 0.57
KDM4E B2RXH2 3/20 0.56
GAA P10253 2/20 0.56
ABCG2 Q9UNQ0 3/20 0.54
FLT1 P17948 1/20 0.54
FLT4 P35916 1/20 0.54
KDR P35968 1/20 0.54
LMNA P02545 3/20 0.53
HTT P42858 1/20 0.53
ADORA2B P29275 1/20 0.53
ADORA1 P30542 1/20 0.53
CDC7 O00311 1/20 0.53
TSHR P16473 3/20 0.52
HSD17B10 Q99714 2/20 0.50
TP53 P04637 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL953597 0.94 ALDH1A1 (0.56) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL24809296 0.91 ABCG2 (0.55) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL16481440 0.90 ALDH1A1 (0.62) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL15455464 0.86 CDC7 (0.49) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL28130804 0.85 ALDH1A1 (0.53) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL16481157 0.85 CDC7 (0.71) ALDH1A1MAPTMEN1KMT2AKCNA5
SCHEMBL15145204 0.85 ALDH1A1 (0.53) ALDH1A1MAPTMEN1KMT2AKCNA5
SCHEMBL10567345 0.85 ABCG2 (0.57) ALDH1A1MAPTMEN1KMT2AABCG2
SCHEMBL15158499 0.83 ALDH1A1 (0.61) ALDH1A1MAPTMEN1KMT2AKCNA5
SCHEMBL5450636 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AKCNA5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4482832-A1 5-[7-(3,4-DIHYDRO-1H-ISOQUINOLINE-2-CARBONYL)-1,2,3,4 TETRAHYDROISOQUINOLIN-6-Y L]-1H-PYRROLE-3-CARBOXAMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS PRO-APOPTOTIC AGENTS Les Laboratoires Servier (FR) 2025-01-01 EP disclosed
US-11839138-B2 Organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-12-05 US disclosed
WO-2023161317-A1 5-[7-(3,4-DIHYDRO-1H-ISOQUINOLINE-2-CARBONYL)-1,2,3,4 TETRAHYDROISOQUINOLIN-6-Y L]-1H-PYRROLE-3-CARBOXAMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS PRO-APOPTOTIC AGENTS LES LABORATOIRES SERVIER (FR) 2023-08-31 WO disclosed
US-20230200225-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT, AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230020436-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-19 US disclosed
US-20230011996-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2023-01-12 US disclosed
US-11552251-B2 Organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-01-10 US disclosed
US-11552252-B1 2023-01-10 US disclosed
US-20220411437-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO.,LTD. (JP) 2022-12-29 US disclosed
US-20220393110-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION, POWDER, ELECTRONIC EQUIPMENT, AND NOVEL COMPOUND IDEMITSU KOSAN CO.,LTD. (CN) 2022-12-08 US disclosed
US-9181474-B2 Amine-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-10 US disclosed
WO-2015009076-A1 A COMBINATION OF A DOPANT COMPOUND AND A HOST COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-01-22 WO disclosed
EP-2626399-B1 Amine-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO LTD (KR) 2014-12-03 EP disclosed
WO-2014058232-A2 SPIRO-TYPE ORGANIC MATERIAL, AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 대주전자재료 주식회사 (KR) 2014-04-17 WO disclosed
WO-2013180456-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-12-05 WO disclosed
US-20130200338-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-08-08 US disclosed
US-20130200338-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-08-08 US disclosed
US-20050171102-A1 Semicarbazide derivatives for combating thromboembolic diseases MERCK PATENT GMBH (DE) 2005-08-04 US disclosed
EP-1501814-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GmbH (DE) 2005-02-02 EP disclosed
WO-2003093254-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GMBH (DE) 2003-11-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230200225-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT, AND ELECTRONIC DEVICE MNS1, NUMA1, NPM1 ALDH1A1 2587/4885MAPT 2590/4885MEN1 337/4885
US-20050171102-A1 Semicarbazide derivatives for combating thromboembolic diseases SERPINC1, F11, F12 ALDH1A1 212/4885MAPT 4863/4885MEN1 201/4885
US-20220411437-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS RPS19, TERT, PIEZO1 ALDH1A1 1341/4885MAPT 3856/4885MEN1 807/4885
US-11552251-B2 Organic electroluminescent element and electronic device L1CAM, ESR1, LEF1 ALDH1A1 125/4885MAPT 1713/4885MEN1 635/4885
US-20230011996-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS PROVIDED WITH THE SAME RER1, RPS19, ESR1 ALDH1A1 273/4885MAPT 4227/4885MEN1 1901/4885
US-20230020436-A1 NOVEL COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC APPARATUS MRPS22, RER1, EMC2 ALDH1A1 1929/4885MAPT 3554/4885MEN1 923/4885
US-20130200338-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME MAOB, DRD2, TYR ALDH1A1 125/4885MAPT 48/4885MEN1 1136/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.