SCHEMBL5983445

SCHEMBL5983445

CC(=O)N(CCC(O)Cc1ccc(F)cc1)NCCc1ccc(C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.40
PTGER2 P43116 4/20 0.40
TBXA2R P21731 1/20 0.40
PTGER3 P43115 1/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MCHR1 Q99705 1/20 0.38
KDM4E B2RXH2 1/20 0.37
APAF1 O14727 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NR4A2 P43354 1/20 0.36
POLB P06746 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
SCHEMBL4943283 0.91 PTGER4 (0.40) PTGER4PTGER2TBXA2RPTGER3OPRM1
SCHEMBL5982548 0.91 PTGER4 (0.45) PTGER4PTGER2OPRM1OPRD1OPRK1
SCHEMBL5988841 0.89 ALDH1A1 (0.41) PTGER4PTGER2NPC1RAB9AALDH1A1
SCHEMBL5983008 0.89 PTGER4 (0.51) PTGER4PTGER2TBXA2RPTGER3OPRM1
SCHEMBL5981555 0.85 ACACB (0.47) PTGER4PTGER2
SCHEMBL5982999 0.83 KMT2A (0.39) PTGER4PTGER2ALDH1A1MAPTSMN1; SMN2
SCHEMBL5983075 0.83 PTGER4 (0.51) PTGER4PTGER2
SCHEMBL5992349 0.83 PTGER4 (0.51) PTGER4PTGER2TBXA2RPTGER3NPC1
SCHEMBL5983282 0.83 BCL2 (0.43) PTGER4PTGER2
SCHEMBL5990886 0.82 PTGER4 (0.53) PTGER4PTGER2TBXA2ROPRM1KDM4E

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
EP-1654219-A2 HYDRAZIDE DERIVATIVES AS PROSTAGLANDIN RECEPTORS MODULATORS Applied Research Systems ARS Holding N.V. (AN) 2006-05-10 EP disclosed
WO-2005012232-A2 HYDRAZIDE DERIVATIVES AS PROSTAGLANDIN RECEPTORS MODULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2005-02-10 WO disclosed