SCHEMBL11264676

SCHEMBL11264676

CC(Oc1ccc(-c2ncc(Cl)cc2Cl)cc1O)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.39
SCN9A Q15858 2/20 0.39
GAA P10253 3/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 3/20 0.37
TSHR P16473 2/20 0.37
MAPK1 P28482 1/20 0.37
HPGD P15428 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CYP1A2 P05177 1/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX12 P18054 1/20 0.36
CYP2C19 P33261 1/20 0.36
PKM P14618 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL10510541 0.89 ALDH1A1 (0.38) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL9763694 0.89 TSHR (0.47) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL11601818 0.89 L3MBTL1 (0.39) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL6732935 0.89 TSHR (0.47) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL10792400 0.88 ALDH1A1 (0.37) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL10760195 0.88 ALDH1A1 (0.40) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL11601705 0.87 LMNA (0.39) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL11440040 0.86 ALDH1A1 (0.38) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL732544 0.86 L3MBTL1 (0.46) GAAALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL10693531 0.86 ALDH1A1 (0.44) FPR2SCN9AGAAALDH1A1KDM4E

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
US-4092151-A ALPHA-(4-(5-MONOSUBSTITUTED OR 3,5-DI-SUBSTITUTED-PYRIDYL-2-OXY)PHENOXY)ALKANECARBOXYLIC ACID AND DERIVATIVES ISHIHARA SANGYO KAISHA, LTD. (JA) 1978-05-30 US claimed
US-4309210-A HERBICIDE AND SAFENING AGENT CIBA-GEIGY CORPORATION (US) 1982-01-05 US disclosed