SCHEMBL9629784

SCHEMBL9629784

Nc1cc(Cl)ccc1Cc1ccc(Cl)cc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.56
CYP3A4 P08684 5/20 0.56
ALDH1A1 P00352 4/20 0.56
TSHR P16473 3/20 0.56
ALOX15 P16050 3/20 0.56
TDP1 Q9NUW8 1/20 0.56
TP53 P04637 1/20 0.54
HPGD P15428 3/20 0.50
ALOX12 P18054 2/20 0.50
MAPK1 P28482 2/20 0.50
HSD17B10 Q99714 1/20 0.50
IDO1 P14902 4/20 0.48
KMT2A Q03164 3/20 0.48
HIF1A Q16665 2/20 0.48
HTT P42858 2/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
SLC22A1 O15245 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL1509590 0.86 TSHR (0.47) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL11778076 0.85 CYP3A4 (0.56) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL9629939 0.84 TSHR (0.50) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL9656059 0.83 CYP3A4 (0.58) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL1509541 0.83 CYP3A4 (0.50) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL358331 0.83 CYP3A4 (0.54) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL535139 0.83 CYP3A4 (0.54) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL29758099 0.83 CYP3A4 (0.54) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
Hydrochloric Acid SCHEMBL25368153 0.81 CYP3A4 (0.52) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15
SCHEMBL202794 0.81 IDO1 (0.61) SMN1; SMN2CYP3A4ALDH1A1TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215312-B1 METHOD FOR PRODUCING OF POLYARYLENE SULFIDES IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1992-03-25 EP disclosed
US-4810773-A HIGH MOLECULAR WEIGHT ENGINEERING THERMOPLASTICS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1989-03-07 US disclosed
EP-0296250-A1 POLYARYLENE SULFIDE AND PROCESS FOR ITS PRODUCTION IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1988-12-28 EP disclosed
EP-0215312-A1 Method for producing of polyarylene sulfides IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1987-03-25 EP disclosed