SCHEMBL28040744

SCHEMBL28040744

O=C(Cl)c1ccc(S)c(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TTR P02766 1/20 0.41
PTPRC P08575 2/20 0.40
KMO O15229 1/20 0.39
KMT2A Q03164 2/20 0.38
POLB P06746 2/20 0.38
BACE1 P56817 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
EGFR P00533 2/20 0.36
MEN1 O00255 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SYK P43405 1/20 0.36
AURKB Q96GD4 1/20 0.36
INCENP Q9NQS7 1/20 0.36

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
SCHEMBL29020339 0.82 MAPT (0.55) ALDH1A1TTRKMT2ASMN1; SMN2MAPT
SCHEMBL1353027 0.80 PTGS2 (0.49) ALDH1A1TTRPTPRCBACE1SMN1; SMN2
SCHEMBL8775411 0.80 HDAC7 (0.42) ALDH1A1TTRKMT2ABACE1SMN1; SMN2
SCHEMBL11750400 0.79 PTPN1 (0.46) ALDH1A1KDM4EFOLH1
Benzene SCHEMBL28149666 0.79 PTPN1 (0.46) ALDH1A1KDM4EFOLH1
SCHEMBL10178616 0.78 NPSR1 (0.38) ALDH1A1TTRPTPRCKMT2ASMN1; SMN2
SCHEMBL9490431 0.76 BCAT2 (0.44) ALDH1A1KMT2ABACE1SMN1; SMN2MAPT
SCHEMBL6207095 0.76 SRD5A2 (0.50) ALDH1A1KMT2AKDM4EEGFRMEN1
SCHEMBL24959804 0.75 ALDH1A1 (0.45) ALDH1A1TTRBACE1SMN1; SMN2MAPT
SCHEMBL24959781 0.75 PTGS1 (0.51) ALDH1A1KMT2ASMN1; SMN2MAPTHPGD

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
CN-103446725-B Golf 邓禄普体育用品株式会社 2016-08-10 CN disclosed
CN-103372285-B Golf DUNLOP SPORTS CO., LTD. (JP) 2016-04-20 CN disclosed
CN-103446723-B Golf DUNLOP SPORTS CO., LTD. (JP) 2015-11-18 CN disclosed