SCHEMBL28417785

SCHEMBL28417785

COc1ccn2cc(C(C)=O)c(C(=O)Nc3cccc(-c4cncnc4)c3F)c2c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 7/20 0.44
▸ ABL1 P00519 3/20 0.41
▸ BRD2 P25440 1/20 0.40
▸ BRD3 Q15059 1/20 0.40
▸ EPHB3 P54753 1/20 0.39
▸ EP300 Q09472 1/20 0.38
▸ ABCB1 P08183 1/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ ATR Q13535 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KCNH2 Q12809 1/20 0.34

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
SCHEMBL28416810 0.92 ABCB1 (0.45) CREBBPBRD2BRD3ABCB1SMN1; SMN2
SCHEMBL28411099 0.89 KDM4E (0.44) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28415697 0.88 CREBBP (0.58) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28891091 0.86 CREBBP (0.41) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28415713 0.86 CREBBP (0.46) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28418185 0.85 CREBBP (0.40) CREBBPABL1BRD2BRD3EPHB3
SCHEMBL28413189 0.85 CREBBP (0.58) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28410723 0.84 CREBBP (0.45) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28418305 0.83 CREBBP (0.43) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28422565 0.83 LCLAT1 (0.40) CREBBPEPHB3EP300RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111320621-A Indolizine compound and preparation method and application thereof 中国科学院广州生物医药与健康研究院 2020-06-23 — — CN disclosed
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