SCHEMBL11258724

SCHEMBL11258724

CCC1CSC(Cc2c(Cl)cc(Cl)cc2Cl)(Cn2ccnc2)S1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.34
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 3/20 0.34
CYP17A1 P05093 2/20 0.34
CYP21A2 P08686 2/20 0.34
HMOX1 P09601 2/20 0.33
CYP11B2 P19099 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 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
SCHEMBL11264521 0.90 HMOX1 (0.36) ADRA2CCYP11B1CYP17A1CYP21A2HMOX1
SCHEMBL11264736 0.90 MAPK1 (0.35) ADRA2CCYP19A1USP2ALDH1A1LMNA
SCHEMBL11273444 0.88 HMOX1 (0.37) ADRA2CCYP19A1CYP11B1CYP17A1CYP21A2
SCHEMBL11269975 0.88 MAPK1 (0.38) USP2ALDH1A1LMNAALOX15HTT
SCHEMBL11257609 0.87 FNTA (0.39) ADRA2CCYP19A1CYP11B1CYP17A1CYP21A2
SCHEMBL11265306 0.84 CYP2A6 (0.45) CYP19A1CYP11B1HMOX1CYP11B2
SCHEMBL11260874 0.84 CYP11B1 (0.46) CYP19A1CYP11B1CYP11B2ALDH1A1LMNA
SCHEMBL11256372 0.81 HMOX1 (0.39) ADRA2CCYP19A1CYP11B1CYP17A1CYP21A2
SCHEMBL11261989 0.81 CYP11B1 (0.45) CYP19A1CYP11B1HMOX1CYP11B2ALDH1A1
SCHEMBL11261268 0.81 ADRA2C (0.40) ADRA2CCYP19A1CYP11B1CYP17A1CYP21A2

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