SCHEMBL11270710

SCHEMBL11270710

Cc1ccc(CC2(Cn3ccnc3)SCCS2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.42
CYP11B2 P19099 5/20 0.42
POLB P06746 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP19A1 P11511 2/20 0.40
TSHR P16473 1/20 0.39
KMT2A Q03164 3/20 0.38
TBXAS1 P24557 1/20 0.36
MEN1 O00255 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
SCHEMBL11255600 0.95 CYP11B1 (0.40) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11266844 0.88 POLB (0.44) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11261911 0.88 CYP11B1 (0.40) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11256534 0.86 TSHR (0.46) POLBCTDSP1TDP1TSHRKMT2A
SCHEMBL11254508 0.85 POLB (0.40) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11259565 0.82 POLB (0.38) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11270651 0.82 CYP11B1 (0.54) CYP11B1CYP11B2CYP19A1
SCHEMBL11268467 0.80 CYP11B1 (0.54) CYP11B1CYP11B2CYP19A1KMT2AMEN1
SCHEMBL11262884 0.80 CYP11B1 (0.35) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11266929 0.80 POLB (0.39) CYP11B1CYP11B2POLBCTDSP1TDP1

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