SCHEMBL473716

SCHEMBL473716

c1c[nH]c2nc3cnccc3c-2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 8/20 0.45
MAPT P10636 1/20 0.44
F7 P08709 2/20 0.41
F3 P13726 2/20 0.41
F10 P00742 1/20 0.41
PDE5A O76074 3/20 0.40
IDO1 P14902 1/20 0.38
KDM4A O75164 1/20 0.38
KDM4B O94953 1/20 0.38
KDM5C P41229 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
KDM3A Q9Y4C1 1/20 0.38
DYRK1A Q13627 2/20 0.37
NFATC1 O95644 1/20 0.37
IKBKE Q14164 1/20 0.37
TBK1 Q9UHD2 1/20 0.37
NPC1 O15118 1/20 0.36
GBA1 P04062 1/20 0.36
KDM5A P29375 1/20 0.36
PIK3CD O00329 1/20 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
SCHEMBL16637911 0.86 TNF (0.41) KDM4CMAPTPDE5AIKBKETBK1
SCHEMBL1180188 0.78 NPC1 (0.47) MAPTIDO1DYRK1ANPC1GBA1
SCHEMBL1181806 0.71 ACHE (0.41) MAPTDYRK1ANPC1GBA1
SCHEMBL17967560 0.69 FGFR1 (0.38) NPC1GBA1
SCHEMBL1849192 0.68 TOP1 (0.45) MAPTNPC1GBA1
SCHEMBL17967674 0.67 PDE5A (0.41) MAPTF7F3F10PDE5A
SCHEMBL4088326 0.66 CHEK2 (0.44) NPC1
SCHEMBL8566063 0.65 ALDH1A1 (0.50) MAPTPDE5ANPC1GSK3B
SCHEMBL4718800 0.63 CHEK2 (0.50)
SCHEMBL14344501 0.62 KDM4C (1.00) KDM4CMAPTPDE5ANPC1KDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12006316-B2 9H-pyrrolo-dipyridine derivatives UCB Biopharma SRL (BE) 2024-06-11 US disclosed
US-20220213103-A1 9H-PYRROLO-DIPYRIDINE DERIVATIVES UCB Biopharma SRL (BE) 2022-07-07 US disclosed
CN-110283134-B Triazine benzene derivative and application thereof 武汉尚赛光电科技有限公司 2021-03-16 CN disclosed
EP-2828250-B1 QUINAZOLINE COMPOUNDS AND THEIR USE IN THERAPY IMPERIAL COLLEGE INNOVATIONS LTD (GB) 2021-03-10 EP disclosed
EP-2513110-B1 1,7-DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER HOFFMANN LA ROCHE (CH) 2018-12-05 EP disclosed
US-9440976-B2 1,7-diazacarbazoles and methods of use GENENTECH, INC. (US) 2016-09-13 US disclosed
US-9440976-B2 1,7-diazacarbazoles and methods of use GENENTECH, INC. (US) 2016-09-13 US disclosed
US-9440976-B2 1,7-diazacarbazoles and methods of use GENENTECH, INC. (US) 2016-09-13 US disclosed
US-9216980-B2 Methods of use of diazacarbazoles for treating cancer GENENTECH, INC. (US) 2015-12-22 US disclosed
US-20150328195-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-11-19 US disclosed
WO-2011073263-A1 1, 7 - DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
WO-2011073263-A1 1, 7 - DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
US-20110118230-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. 2011-05-19 US disclosed
US-20110118230-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. 2011-05-19 US disclosed
EP-2300475-A1 DIAZACARBAZOLES AND METHODS OF USE Genentech, Inc. (US) 2011-03-30 EP disclosed
EP-2300475-A1 DIAZACARBAZOLES AND METHODS OF USE Genentech, Inc. (US) 2011-03-30 EP disclosed
WO-2010109084-A2 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-30 WO disclosed
WO-2009151598-A8 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2010-05-06 WO disclosed
WO-2009151598-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2009-12-17 WO disclosed
WO-2009151598-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2009-12-17 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 (4 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-20220213103-A1 9H-PYRROLO-DIPYRIDINE DERIVATIVES MAPT, PSEN1, PRNP KDM4C 2769/4885MAPT 1/4885F7 2925/4885
US-20110118230-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B KDM4C 717/4885MAPT 4241/4885F7 3657/4885
US-20150328195-A1 1,7-DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B KDM4C 900/4885MAPT 3924/4885F7 3016/4885
US-12006316-B2 9H-pyrrolo-dipyridine derivatives MAPT, PSEN1, PRNP KDM4C 2769/4885MAPT 1/4885F7 2925/4885

“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.