SCHEMBL19631208

SCHEMBL19631208

CCc1ccc(SC)c(-c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 3/20 0.44
NPC1 O15118 2/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 1/20 0.41
TP53 P04637 1/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
BACE1 P56817 1/20 0.37
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
PSMB5 P28074 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
SCHEMBL1784380 0.87 MAPT (0.46) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL1787928 0.87 MAPT (0.46) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL1784382 0.84 MAPT (0.43) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL25812009 0.81 TP53 (0.43) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL8459740 0.79 MAPT (0.57) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL9579979 0.78 ALDH1A1 (0.48) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL18594367 0.77 ALDH1A1 (0.43) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL7169867 0.76 MAPT (0.53) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL9914232 0.76 HDAC7 (0.45) MAPTSMN1; SMN2RAB9AALDH1A1LMNA
SCHEMBL2649579 0.74 MAOA (0.42) MAPTSMN1; SMN2RAB9AALDH1A1LMNA

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-10246536-B2 Functionalized highly syndiotactic polystyrene and preparation method thereof CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2019-04-02 US disclosed
US-20170335036-A1 FUNCTIONALIZED HIGHLY SYNDIOTACTIC POLYSTYRENE AND PREPARATION METHOD THEREOF CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2017-11-23 US disclosed