SCHEMBL27896908

SCHEMBL27896908

COc1cc2cc(N)ccc2n1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRPF1 P55201 2/20 0.53
▸ PRKCI P41743 1/20 0.47
▸ CHEK1 O14757 1/20 0.39
▸ AURKA O14965 1/20 0.39
▸ DAPK3 O43293 1/20 0.39
▸ CSNK1A1 P48729 1/20 0.39
▸ GSK3A P49840 1/20 0.39
▸ LIMK1 P53667 1/20 0.39
▸ IKBKE Q14164 1/20 0.39
▸ MAPK14 Q16539 1/20 0.39
▸ TAOK1 Q7L7X3 1/20 0.39
▸ CLK4 Q9HAZ1 1/20 0.39
▸ DYRK1B Q9Y463 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.39
▸ MAPT P10636 4/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL3481207 0.75 BRPF1 (0.62) BRPF1PRKCIALDH1A1MAPTKDM4E
SCHEMBL30193576 0.75 KMT2A (0.50) BRPF1ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL4912683 0.75 KMT2A (0.50) BRPF1ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL31036167 0.75 BRPF1 (0.62) BRPF1PRKCIALDH1A1MAPTKDM4E
SCHEMBL6263704 0.74 BRPF1 (0.42) BRPF1
Hydrochloric Acid SCHEMBL27614396 0.73 BRPF1 (0.61) BRPF1PRKCIALDH1A1MAPTKDM4E
SCHEMBL28281962 0.73 BRPF1 (0.56) BRPF1PRKCICHEK1AURKADAPK3
SCHEMBL3061254 0.71 L3MBTL1 (0.70) BRPF1PRKCICHEK1AURKADAPK3
SCHEMBL1465796 0.70 BRPF1 (0.53) BRPF1PRKCICHEK1AURKADAPK3
Dimethylamine SCHEMBL11499079 0.70 KMT2A (0.46) BRPF1ALDH1A1MAPTKDM4EHPGD

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
CN-102781914-B Indole derivatives TAKEDA PHARMACEUTICAL 2014-09-17 — — CN disclosed
CN-102781914-A Indole derivatives TAKEDA PHARMACEUTICAL 2012-11-14 — — CN disclosed
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