SCHEMBL11526850

SCHEMBL11526850

CCCN1C(=O)Cc2cc(F)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 2/20 0.48
BMPR1A P36894 2/20 0.48
TGFBR1 P36897 2/20 0.48
ACVRL1 P37023 2/20 0.48
ACVR1 Q04771 2/20 0.48
PER2 O15055 1/20 0.43
CRY2 Q49AN0 1/20 0.43
BRD4 O60885 1/20 0.43
CHRM1 P11229 2/20 0.42
PARK7 Q99497 2/20 0.42
GAA P10253 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM3 P20309 1/20 0.39
MEN1 O00255 1/20 0.39
CASP6 P55212 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPK1 P28482 1/20 0.39
USP2 O75604 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
SCHEMBL11529967 0.87 BRD4 (0.55) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL8146689 0.84 BMPR1B (0.47) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL7824808 0.84 MEN1 (0.42) PER2CRY2BRD4CHRM1GAA
SCHEMBL29577669 0.81 HRH1 (0.47) CHRM1ALDH1A1PTGDR2CHRM5CHRM3
SCHEMBL31356492 0.81 BMPR1B (0.46) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL26021803 0.81 BMPR1B (0.48) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL5116351 0.81 ATAD2 (0.57) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL22667347 0.81 BMPR1B (0.51) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL10749668 0.81 BMPR1B (0.48) BMPR1BBMPR1ATGFBR1ACVRL1ACVR1
SCHEMBL29578483 0.80 CHRM1 (0.53) CHRM1CHRM5CHRM3

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
US-4160032-A Oxindoles as sleep-inducers SANDOZ, INC. (US) 1979-07-03 US disclosed