SCHEMBL6966015

SCHEMBL6966015

CNc1ccccc1CC([O])=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
POLB P06746 2/20 0.44
ATM Q13315 1/20 0.44
PTGS2 P35354 5/20 0.44
CXCL8 P10145 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 3/20 0.41
RECQL P46063 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AR P10275 1/20 0.41
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
NR1H4 Q96RI1 2/20 0.40
PTGS1 P23219 2/20 0.40
AKR1B10 O60218 1/20 0.40
UGT1A9 O60656 1/20 0.40
TRPA1 O75762 1/20 0.40
ABCB11 O95342 1/20 0.40
MT-CO2 P00403 1/20 0.40
TTR P02766 1/20 0.40

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
SCHEMBL6275740 0.84 L3MBTL1 (0.46) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL1964864 0.84 PTGS2 (0.60) PTGS2CXCL8NR1H4PTGS1AKR1B10
SCHEMBL22316652 0.82 KMT2A (0.45) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL3743443 0.82 KDM4E (0.43) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL24260205 0.81 L3MBTL1 (0.46) KDM4EPOLBATMPTGS2CXCL8
Ammonia Solution, Strong SCHEMBL28139473 0.81 KDM4E (0.42) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL11989069 0.81 KDM4E (0.50) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL6970823 0.81 ALDH1A1 (0.53) KDM4EPOLBALDH1A1SMN1; SMN2NR1H4
SCHEMBL19574717 0.79 PTGS2 (0.41) KDM4EPOLBATMPTGS2CXCL8
SCHEMBL18294035 0.79 MAPT (0.44) KDM4EPOLBATMPTGS2CXCL8

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed