SCHEMBL28422565

SCHEMBL28422565

COc1ccn2cc(C(C)=O)c(C(=O)Nc3cccc(-c4ccco4)c3F)c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCLAT1 Q6UWP7 1/20 0.40
▸ CREBBP Q92793 6/20 0.40
▸ EP300 Q09472 1/20 0.40
▸ BAZ2B Q9UIF8 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ RAB9A P51151 5/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ APBA1 Q02410 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL28419951 0.87 SMN1; SMN2 (0.39) CREBBPALDH1A1MEN1KMT2AMAPT
SCHEMBL28891091 0.86 CREBBP (0.41) CREBBPEP300MAPTRAB9ASMN1; SMN2
SCHEMBL28411099 0.86 KDM4E (0.44) CREBBPEP300ALDH1A1KMT2AMAPT
SCHEMBL28410730 0.85 CREBBP (0.40) CREBBPALDH1A1MEN1KMT2AMAPT
SCHEMBL28418305 0.83 CREBBP (0.43) CREBBPEP300RAB9ASMN1; SMN2NPC1
SCHEMBL28417785 0.83 CREBBP (0.44) CREBBPEP300MAPTRAB9ASMN1; SMN2
SCHEMBL28416810 0.82 ABCB1 (0.45) CREBBPALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL28881176 0.82 CREBBP (0.56) LCLAT1CREBBPBAZ2BMAPTTP53
SCHEMBL28415934 0.81 CREBBP (0.40) CREBBPEP300MEN1KMT2AMAPT
SCHEMBL28415697 0.81 CREBBP (0.58) CREBBPEP300EPHB3

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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