SCHEMBL10468191

SCHEMBL10468191

Cn1cc(C[C@H]2NC(=O)[C@@H](Cc3cn(C)c4ccccc34)NC2=O)c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.57
HTR2A P28223 1/20 0.51
CA2 P00918 1/20 0.48
SLC6A4 P31645 1/20 0.47
CCKBR P32239 2/20 0.46
CCNE2 O96020 1/20 0.45
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
AHR P35869 2/20 0.45
CMA1 P23946 1/20 0.45
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
ALDH1A1 P00352 1/20 0.42
IMPDH2 P12268 1/20 0.42

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
SCHEMBL10467549 0.93 GPR84 (0.50) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10467558 0.93 GPR84 (0.50) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10468796 0.92 HDAC3 (0.51) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10467230 0.91 GPR84 (0.48) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10468784 0.91 GPR84 (0.48) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10467137 0.91 HDAC3 (0.48) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10569279 0.91 GPR84 (0.48) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10469080 0.89 GPR84 (0.47) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10467635 0.88 GPR84 (0.46) GPR84HTR2ACA2SLC6A4CCKBR
SCHEMBL10466784 0.88 GPR84 (0.46) GPR84HTR2ACA2SLC6A4CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4940709-A PLATELET ACTIVATING FACTOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-07-10 US disclosed
EP-0181152-B1 PIPERAZINE COMPOUND AS PAF-ANTAGONIST FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-09-13 EP disclosed
US-4806538-A ANTICOAGULANT, HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-02-21 US disclosed