SCHEMBL11265408

SCHEMBL11265408

Clc1cc(Cl)c(CCC2(CCn3ccnc3)SCCS2)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
USP2 O75604 2/20 0.38
MAPK1 P28482 2/20 0.38
CYP19A1 P11511 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 2/20 0.37
ALOX12 P18054 1/20 0.37
MEN1 O00255 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
ADRA2C P18825 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
SCHEMBL11264631 0.89 ADRA2C (0.39) CYP19A1ADRA2C
SCHEMBL11256509 0.89 LMNA (0.38) LMNAMAPTUSP2MAPK1CYP19A1
SCHEMBL11255287 0.88 USP2 (0.37) LMNAUSP2MAPK1CYP19A1ALOX15
SCHEMBL11252662 0.87 LMNA (0.35) LMNAMAPTUSP2MAPK1ALOX15
SCHEMBL11260943 0.84 ADRA2C (0.38) CYP19A1ADRA2C
SCHEMBL11258066 0.84 USP2 (0.36) LMNAUSP2MAPK1CYP19A1ALOX15
SCHEMBL11270296 0.82 LMNA (0.42) LMNAMAPTUSP2MAPK1ALOX15
SCHEMBL11264094 0.82 ADRA2C (0.38) LMNAUSP2MAPK1CYP19A1ALOX15
SCHEMBL11270723 0.81 CYP2A6 (0.51) CYP19A1
SCHEMBL11256067 0.81 CYP2C9 (0.42) LMNAMAPTUSP2MAPK1CYP19A1

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