SCHEMBL11270296

SCHEMBL11270296

Clc1cc(Cl)c(CC2(CCCn3ccnc3)SCCS2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.42
USP2 O75604 2/20 0.42
MAPK1 P28482 2/20 0.42
ALOX15 P16050 1/20 0.42
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
TBXAS1 P24557 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL11263798 0.95 LMNA (0.40) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11256509 0.93 LMNA (0.38) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11266452 0.88 MAPK1 (0.41) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11267726 0.87 MAPK1 (0.39) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11261268 0.85 ADRA2C (0.40) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11266636 0.85 MAPK1 (0.40) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11269975 0.82 MAPK1 (0.38) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11262189 0.82 CYP2A6 (0.50) SMN1; SMN2ALDH1A1TP53
SCHEMBL11265408 0.82 LMNA (0.38) LMNAUSP2MAPK1ALOX15MAPT
SCHEMBL11264094 0.81 ADRA2C (0.38) LMNAUSP2MAPK1ALOX15KMT2A

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