SCHEMBL28891091

SCHEMBL28891091

COc1ccn2cc(C(C)=O)c(C(=O)Nc3cccc(-c4ccoc4)c3F)c2c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 7/20 0.41
▸ DHODH Q02127 2/20 0.37
▸ BRD2 P25440 1/20 0.37
▸ BRD3 Q15059 1/20 0.37
▸ RAB9A P51151 3/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ EPHB3 P54753 1/20 0.35
▸ TP53 P04637 2/20 0.35
▸ EP300 Q09472 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ NR4A2 P43354 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ GAA P10253 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
SCHEMBL28411099 0.89 KDM4E (0.44) CREBBPDHODHBRD2BRD3RAB9A
SCHEMBL28422565 0.86 LCLAT1 (0.40) CREBBPRAB9ASMN1; SMN2POLBNPC1
SCHEMBL28417785 0.86 CREBBP (0.44) CREBBPBRD2BRD3RAB9ASMN1; SMN2
SCHEMBL28416810 0.85 ABCB1 (0.45) CREBBPBRD2BRD3SMN1; SMN2KDM4E
SCHEMBL28415697 0.85 CREBBP (0.58) CREBBPBRD2BRD3EPHB3EP300
SCHEMBL28419951 0.84 SMN1; SMN2 (0.39) CREBBPBRD2BRD3RAB9ASMN1; SMN2
SCHEMBL28418305 0.83 CREBBP (0.43) CREBBPBRD2BRD3RAB9ASMN1; SMN2
SCHEMBL28415713 0.83 CREBBP (0.46) CREBBPBRD2BRD3RAB9ASMN1; SMN2
SCHEMBL28881198 0.82 CREBBP (0.58) CREBBPBRD2BRD3TP53MAPT
SCHEMBL28415934 0.81 CREBBP (0.40) CREBBPDHODHBRD2BRD3RAB9A

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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