SCHEMBL8980647

SCHEMBL8980647

Cc1ccc(O)c(C(=O)NCCO)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 2/20 0.58
MAPT P10636 1/20 0.58
CASP1 P29466 1/20 0.58
CASP7 P55210 1/20 0.58
CDK1 P06493 1/20 0.55
CSNK2A1 P68400 1/20 0.53
NAAA Q02083 1/20 0.50
MMP13 P45452 1/20 0.49
GRM5 P41594 1/20 0.48
P2RX1 P51575 1/20 0.48
TMPRSS4 Q9NRS4 1/20 0.48
HTT P42858 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
POLB P06746 2/20 0.47
PLAU P00749 2/20 0.47
F2 P00734 1/20 0.47
F10 P00742 1/20 0.47

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
SCHEMBL18645554 0.87 NAAA (0.57) KDM4EALDH1A1CDK1CSNK2A1NAAA
SCHEMBL8980662 0.87 KDM4E (0.58) KDM4EALDH1A1MAPTCASP1CASP7
SCHEMBL24454271 0.85 CSNK2A1 (0.51) KDM4EALDH1A1CDK1CSNK2A1NAAA
SCHEMBL18646519 0.84 NAAA (0.67) KDM4EALDH1A1CDK1CSNK2A1NAAA
SCHEMBL12855992 0.84 CSNK2A1 (0.54) KDM4EALDH1A1CDK1CSNK2A1NAAA
Gentisic Acid Ethanolamide SCHEMBL1179368 0.83 NAAA (0.65) KDM4EALDH1A1MAPTCASP1CASP7
SCHEMBL13753913 0.83 CSNK2A1 (0.56) KDM4EMAPTCSNK2A1NAAAGRM5
Gentisic Acid Ethanolamide SCHEMBL29379843 0.83 NAAA (0.65) KDM4EALDH1A1MAPTCASP1CASP7
SCHEMBL18645728 0.83 NAAA (0.74) KDM4EALDH1A1CDK1NAAAHTT
SCHEMBL14243219 0.82 SMN1; SMN2 (0.50) KDM4EALDH1A1MAPTCASP1CASP7

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
WO-2007065261-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITORS AMERICAN DIAGNOSTICA INC. (US) 2007-06-14 WO disclosed
EP-0711286-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.p.A. (IT) 1996-05-15 EP disclosed
WO-1995004048-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.P.A. (IT) 1995-02-09 WO disclosed