SCHEMBL8895481

SCHEMBL8895481

CCCCOc1ccc(CCC(NS(=O)(=O)c2ccc(Cl)cc2)c2ccc(CCCC(=O)OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
UTS2R Q9UKP6 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
MMP13 P45452 3/20 0.40
MMP3 P08254 2/20 0.40
ATM Q13315 1/20 0.40
MMP1 P03956 2/20 0.40
MMP2 P08253 2/20 0.40
ADAMTS4 O75173 1/20 0.40
MMP14 P50281 1/20 0.40
ADAMTS5 Q9UNA0 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
SCHEMBL8897143 0.98 KMT2A (0.45) KMT2AMEN1UTS2RSMN1; SMN2ALDH1A1
SCHEMBL8895228 0.97 KMT2A (0.45) KMT2AMEN1UTS2RSMN1; SMN2ALDH1A1
SCHEMBL8896098 0.93 UTS2R (0.46) KMT2AMEN1UTS2RALDH1A1CYP1A2
SCHEMBL8895435 0.93 UTS2R (0.45) KMT2AMEN1UTS2RALDH1A1CYP1A2
SCHEMBL8895299 0.92 MEN1 (0.47) KMT2AMEN1UTS2RSMN1; SMN2ALDH1A1
SCHEMBL8896463 0.92 UTS2R (0.44) KMT2AMEN1UTS2RALDH1A1CYP1A2
SCHEMBL8898667 0.92 UTS2R (0.44) KMT2AMEN1UTS2RALDH1A1CYP1A2
SCHEMBL8897066 0.92 UTS2R (0.49) KMT2AMEN1UTS2RALDH1A1CYP1A2
SCHEMBL8898580 0.91 ALDH1A1 (0.49) KMT2AMEN1UTS2RSMN1; SMN2ALDH1A1
SCHEMBL8895046 0.91 UTS2R (0.47) KMT2AMEN1UTS2RALDH1A1CYP1A2

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-5597848-A PLATELET AGGREGATION INHIBITORS, ANTITHROMBOTIC AGENTS, ANTIASTHMATIC AGENTS, ANTIALLERGIC AGENTS HOKURIKU SEIYAKU CO., LTD. (JP) 1997-01-28 US disclosed
EP-0663392-A1 BENZENESULFONAMIDE DERIVATIVE AND USE THEREOF HOKURIKU SEIYAKU CO., LTD. (JP) 1995-07-19 EP disclosed