SCHEMBL14518255

SCHEMBL14518255

Cc1cc(C)c2c(c1)n(CC=O)c(=O)n2C

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ C5AR1 P21730 1/20 0.44
▸ CALCRL Q16602 1/20 0.39
▸ ABCB1 P08183 8/20 0.32
▸ GAA P10253 1/20 0.31
▸ DAO P14920 1/20 0.31
▸ ATAD2 Q6PL18 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ CRHR1 P34998 1/20 0.30

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
SCHEMBL14198765 0.79 KMT2A (0.58) KMT2ASMN1; SMN2C5AR1CALCRL
SCHEMBL12362418 0.77 KMT2A (0.57) KMT2ASMN1; SMN2C5AR1CALCRLDAO
SCHEMBL12362443 0.76 KMT2A (0.54) KMT2ASMN1; SMN2C5AR1CALCRL
SCHEMBL12362417 0.76 SMN1; SMN2 (0.54) KMT2ASMN1; SMN2C5AR1CALCRLNPC1
SCHEMBL12362442 0.74 KMT2A (0.53) KMT2ASMN1; SMN2C5AR1CALCRLGAA
SCHEMBL14518251 0.73 KMT2A (0.51) KMT2ASMN1; SMN2C5AR1GAA
SCHEMBL12362445 0.73 KMT2A (0.54) KMT2ASMN1; SMN2C5AR1CALCRL
SCHEMBL261520 0.71 CALCRL (0.46) KMT2ASMN1; SMN2C5AR1CALCRL
SCHEMBL14198898 0.69 DAO (0.55) KMT2ASMN1; SMN2C5AR1CALCRLABCB1
SCHEMBL14198762 0.69 KMT2A (0.40) KMT2ASMN1; SMN2C5AR1NPC1RAB9A

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-7202251-B2 Bicyclic anilide spirohydantoin CGRP receptor antagonists MERCK & CO., INC. (US) 2007-04-10 — — US disclosed
US-7202251-B2 Bicyclic anilide spirohydantoin CGRP receptor antagonists MERCK & CO., INC. (US) 2007-04-10 — — US disclosed
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