SCHEMBL11264736

SCHEMBL11264736

CCC1CSC(CCn2ccnc2)(Cc2c(Cl)cc(Cl)cc2Cl)S1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.35
ALOX15 P16050 3/20 0.35
USP2 O75604 2/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.33
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 5/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
TP53 P04637 2/20 0.31
HTT P42858 2/20 0.31
GAA P10253 1/20 0.31
ADRA2C P18825 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL11269975 0.94 MAPK1 (0.38) MAPK1ALOX15USP2LMNAMEN1
SCHEMBL11260920 0.90 LMNA (0.34) MAPK1ALOX15USP2LMNAMEN1
SCHEMBL11258724 0.90 ADRA2C (0.34) ALOX15USP2LMNACYP19A1ALDH1A1
SCHEMBL11253462 0.89 MAPK1 (0.37) MAPK1ALOX15USP2LMNAMEN1
SCHEMBL11270007 0.88 MAPK1 (0.36) MAPK1ALOX15USP2LMNAMEN1
SCHEMBL11252157 0.87 FNTA (0.38) LMNAKMT2AMAPTCYP19A1ALDH1A1
SCHEMBL11266076 0.85 TBXAS1 (0.37) MAPK1ALOX15USP2LMNAMEN1
SCHEMBL11258901 0.84 CYP2A6 (0.43) CYP19A1KDM4ETP53TSHR
SCHEMBL11264521 0.84 HMOX1 (0.36) ADRA2C
SCHEMBL11253398 0.83 ALDH1A1 (0.41) MAPK1ALOX15LMNACYP19A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4359475-A SPERMICIDES, MICROBIOCIDES OR ANTICONVULSANTS SYNTEX (U.S.A.) INC. (US) 1982-11-16 US disclosed