SCHEMBL7058842

SCHEMBL7058842

Oc1c[c]c(-c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 2/20 0.48
MMP3 P08254 1/20 0.48
ALOX5 P09917 1/20 0.40
ESR2 Q92731 4/20 0.38
ESR1 P03372 4/20 0.38
TDP1 Q9NUW8 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
GLA P06280 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
BACE1 P56817 1/20 0.36
NTSR1 P30989 2/20 0.35
RPS6KA3 P51812 2/20 0.35
ALDH1A1 P00352 2/20 0.35

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
SCHEMBL11080352 0.78 MAPK1 (0.38) ALOX5ESR2ESR1TDP1CA12
SCHEMBL2958548 0.76 ALDH1A1 (0.45) BCL2L1MMP3ALOX5TDP1CA12
SCHEMBL2448169 0.76 ALDH1A1 (0.45) BCL2L1MMP3ALOX5TDP1CA12
SCHEMBL5047733 0.75 ALDH1A1 (0.47) BCL2L1MMP3TDP1MEN1KMT2A
SCHEMBL781962 0.73 LMNA (0.38) TDP1MEN1KMT2ANTSR1ALDH1A1
SCHEMBL2922472 0.73 ALDH1A1 (0.35) ALOX5ALDH1A1NPC1
SCHEMBL9316232 0.73 HSD17B10 (0.48) TDP1GLAMEN1KMT2AALDH1A1
SCHEMBL358614 0.73 CYP1A2 (0.48) MEN1KMT2AALDH1A1HPGDHSD17B10
SCHEMBL15475160 0.71 SMN1; SMN2 (0.38) ESR2ESR1MEN1KMT2AALDH1A1
SCHEMBL9057820 0.70 WDR5 (0.57) KMT2ALMNA

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003028725-A1 4-(1-PIPERIDINY)-BUTYLCARBOXAMIDE AS D3 DOPAMINE RECEPTOR SUBTYPE SELECTIVE LIGANDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-04-10 WO claimed
WO-2021006267-A1 SALT OF PYRAZOLE DERIVATIVE AND PREPARATION OF PYRAZOLE DERIVATIVE グリーン・テック株式会社 2021-01-14 WO disclosed
WO-2020235582-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT FOR MOTOR NEURON DISEASE グリーン・テック株式会社 (JP) 2020-11-26 WO disclosed
EP-3323816-A1 NOVEL PYRAZOLE DERIVATIVE Green Tech Co., Ltd. (JP) 2018-05-23 EP disclosed
US-9399635-B2 Pyrazole derivative GREEN TECH CO., LTD. (JP) 2016-07-26 US disclosed
US-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PHARMA EIGHT CO., LTD. (JP) 2014-03-27 US disclosed
EP-2698368-A1 NOVEL PYRAZOLE DERIVATIVE Pharma Eight Co. Ltd (JP) 2014-02-19 EP disclosed
WO-2003028725-A1 4-(1-PIPERIDINY)-BUTYLCARBOXAMIDE AS D3 DOPAMINE RECEPTOR SUBTYPE SELECTIVE LIGANDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-04-10 WO disclosed
EP-0508424-B1 Method for preparing sulfones SANKO KAIHATSU KAGAKU KENK (JP) 1998-02-04 EP disclosed
US-5371105-A Agrochemically active substrance mixed with crystal growth inhibitor HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-06 US disclosed
EP-0357559-B1 Aqueous formulations and their use HOECHST AG (DE) 1994-10-19 EP disclosed
US-5248828-A Method for preparing sulfones SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1993-09-28 US disclosed
US-5235084-A METHOD FOR PREPARING SULFONES SANKO KAIHATSU KAGAKU KENKYUSHO (JP) 1993-08-10 US disclosed
EP-0508424-A2 Method for preparing sulfones Sanko Kaihatsu Kagaku Kenkyusho (JP) 1992-10-14 EP disclosed
EP-0357559-A2 Aqueous formulations and their use AgrEvo UK Limited (GB) 1990-03-07 EP 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 (1 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-20140088029-A1 NOVEL PYRAZOLE DERIVATIVE PSEN2, MAPT, PSEN1 BCL2L1 2355/4885MMP3 2979/4885ALOX5 4329/4885

“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.