SCHEMBL11273497

SCHEMBL11273497

CC1CSC(CCCc2c(Cl)cc(Cl)cc2Cl)(Cn2ccnc2)S1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HMOX1 P09601 2/20 0.39
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ADRA2C P18825 1/20 0.34
CYP19A1 P11511 1/20 0.33

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
SCHEMBL11269757 0.94 HMOX1 (0.40) HMOX1ADRA2CCYP19A1
SCHEMBL11273444 0.87 HMOX1 (0.37) HMOX1USP2LMNAALOX15MAPK1
SCHEMBL11259912 0.87 HMOX1 (0.41) HMOX1LMNAADRA2CCYP19A1
SCHEMBL11251184 0.87 HMOX1 (0.36) HMOX1USP2LMNAALOX15MAPK1
SCHEMBL11264094 0.85 ADRA2C (0.38) HMOX1USP2LMNAALOX15MAPK1
SCHEMBL11270183 0.84 HMOX1 (0.53) HMOX1
SCHEMBL11258066 0.84 USP2 (0.36) HMOX1USP2LMNAALOX15MAPK1
SCHEMBL11266636 0.83 MAPK1 (0.40) USP2LMNAALOX15MAPK1MEN1
SCHEMBL11265343 0.83 HMOX1 (0.34) HMOX1USP2LMNAALOX15MAPK1
SCHEMBL11259960 0.83 CYP11B1 (0.44) HMOX1MEN1KMT2A

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