SCHEMBL11264094

SCHEMBL11264094

Clc1cc(Cl)c(CCCC2(Cn3ccnc3)SCCS2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.38
CYP19A1 P11511 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HMOX1 P09601 2/20 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
SCHEMBL11264631 0.93 ADRA2C (0.39) ADRA2CCYP19A1HMOX1
SCHEMBL11260943 0.88 ADRA2C (0.38) ADRA2CCYP19A1HMOX1
SCHEMBL11251184 0.86 HMOX1 (0.36) ADRA2CUSP2LMNAALOX15MAPK1
SCHEMBL11261268 0.85 ADRA2C (0.40) ADRA2CCYP19A1USP2LMNAALOX15
SCHEMBL11265343 0.85 HMOX1 (0.34) USP2LMNAALOX15MAPK1MEN1
SCHEMBL11273497 0.85 HMOX1 (0.39) ADRA2CCYP19A1USP2LMNAALOX15
SCHEMBL11265408 0.82 LMNA (0.38) ADRA2CCYP19A1USP2LMNAALOX15
SCHEMBL11272917 0.82 HMOX1 (0.51) CYP19A1HMOX1
SCHEMBL11263905 0.81 ADRA2C (0.41) ADRA2CCYP19A1LMNAKMT2A
SCHEMBL11270296 0.81 LMNA (0.42) USP2LMNAALOX15MAPK1MEN1

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