SCHEMBL7369210

SCHEMBL7369210

N#Cc1ccc(Nc2ccc3[nH]ccc3c2)c(N)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 1/20 0.59
▸ IMPDH1 P20839 1/20 0.59
▸ KDM4E B2RXH2 2/20 0.56
▸ GAA P10253 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ GABRP O00591 1/20 0.44
▸ GABRD O14764 1/20 0.44
▸ GABRA1 P14867 1/20 0.44
▸ GABRB1 P18505 1/20 0.44
▸ GABRG2 P18507 1/20 0.44
▸ GABRB3 P28472 1/20 0.44
▸ GABRA5 P31644 1/20 0.44
▸ GABRA3 P34903 1/20 0.44
▸ GABRA2 P47869 1/20 0.44
▸ GABRB2 P47870 1/20 0.44
▸ GABRA4 P48169 1/20 0.44
▸ GABRE P78334 1/20 0.44
▸ GABRA6 Q16445 1/20 0.44
▸ GABRG1 Q8N1C3 1/20 0.44
▸ GABRG3 Q99928 1/20 0.44

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
SCHEMBL8879157 0.80 MAOB (0.53) KDM4EGAAGFEREGFRFGFR2
SCHEMBL7367851 0.79 LRRK2 (0.58) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL7185783 0.79 EGFR (0.53) IMPDH2IMPDH1GABRPGABRDGABRA1
SCHEMBL2542670 0.77 KDM4E (0.53) KDM4EGAAALDH1A1LRRK2PRKCI
SCHEMBL91366 0.76 IMPDH2 (1.00) IMPDH2IMPDH1GAAGABRPGABRD
SCHEMBL30389000 0.76 IMPDH2 (1.00) IMPDH2IMPDH1GAAGABRPGABRD
Hydrochloric Acid SCHEMBL27803164 0.75 IMPDH2 (0.96) IMPDH2IMPDH1GAAGABRPGABRD
SCHEMBL28194905 0.75 IMPDH2 (0.96) IMPDH2IMPDH1GAAGABRPGABRD
SCHEMBL2542673 0.74 KDM4E (0.53) KDM4EGAAALDH1A1LRRK2PRKCI
SCHEMBL8548736 0.73 FGFR2 (0.55) EGFRPRKCQPRKCDFGFR2FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688809-A 5-heteroarylindole derivatives PFIZER INC. (US) 1997-11-18 — — US disclosed
WO-1995021836-A1 5-HETEROARYLINDOLE DERIVATIVES AS BENZODIAZEPINE RECEPTOR SITE AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1995-08-17 — — WO disclosed
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