SCHEMBL11633397

SCHEMBL11633397

Cc1ccc(C=CC(O)Cn2ccnc2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.43
CYP11B2 P19099 4/20 0.43
POLB P06746 2/20 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 2/20 0.39
ADRA2C P18825 1/20 0.39

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
SCHEMBL11633392 1.00 CYP11B1 (0.43) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11633402 1.00 CYP11B1 (0.43) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11635085 0.82 ALDH1A1 (0.52) CYP11B1CYP11B2CYP19A1KMT2A
SCHEMBL11635397 0.78 ADRA2C (0.60) TDP1CYP19A1TSHRKMT2AADRA2C
SCHEMBL11635395 0.78 ADRA2C (0.60) TDP1CYP19A1TSHRKMT2AADRA2C
SCHEMBL11635400 0.78 ADRA2C (0.60) TDP1CYP19A1TSHRKMT2AADRA2C
SCHEMBL11635026 0.73 AGER (0.48) CYP11B1CYP11B2POLBCYP19A1KMT2A
SCHEMBL11631263 0.73 AGER (0.48) CYP11B1CYP11B2POLBCYP19A1KMT2A
SCHEMBL28739424 0.72 ADRA2C (0.56) CYP11B1CYP11B2POLBCTDSP1TDP1
SCHEMBL11635373 0.71 CYP19A1 (0.48) CYP11B1CYP11B2POLBCYP19A1KMT2A

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-4078071-A FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS SYNTEX (U.S.A.) INC. (US) 1978-03-07 US disclosed