SCHEMBL9629034

SCHEMBL9629034

Nc1ccc([S+]([O-])c2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.41
TP53 P04637 2/20 0.41
CYP3A4 P08684 5/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ITGB2 P05107 1/20 0.36
ICAM1 P05362 1/20 0.36
ITGAL P20701 1/20 0.36
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
ALDH1A1 P00352 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
ALOX15 P16050 2/20 0.33
PDE7A Q13946 3/20 0.33
PDE7B Q9NP56 1/20 0.33
HTR2B P41595 1/20 0.33
PDE4D Q08499 1/20 0.33
HSD17B10 Q99714 2/20 0.32
ALOX12 P18054 2/20 0.32

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
SCHEMBL10536646 0.82 IDO1 (0.41) TSHRTP53CYP3A4ALDH1A1TDP1
SCHEMBL10537822 0.82 TSHR (0.41) TSHRTP53CYP3A4MEN1KMT2A
SCHEMBL9629161 0.81 CYP3A4 (0.40) TSHRCYP3A4MEN1KMT2ASMN1; SMN2
SCHEMBL9808986 0.79 CYP3A4 (0.42) TSHRTP53CYP3A4MAOAALDH1A1
SCHEMBL11659032 0.79 CYP3A4 (0.42) TSHRTP53CYP3A4MEN1KMT2A
SCHEMBL10923598 0.78 MEN1 (0.50) TSHRTP53CYP3A4MEN1KMT2A
SCHEMBL9228682 0.74 POLB (0.33) ALDH1A1MAPT
SCHEMBL29359062 0.73 TP53 (0.36) TP53MEN1KMT2ALMNA
SCHEMBL310582 0.71 MEN1 (0.50) TSHRTP53CYP3A4MEN1KMT2A
SCHEMBL9808930 0.70 HSD17B10 (0.51) TSHRMEN1KMT2AALDH1A1SMN1; SMN2

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