SCHEMBL28869336

SCHEMBL28869336

Fc1ccc(Cn2ccnc2)cc1C(F)(F)F

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 9/20 0.58
CYP19A1 P11511 8/20 0.58
CYP11B2 P19099 8/20 0.58
CYP2A6 P11509 1/20 0.55
CYP2B6 P20813 1/20 0.55

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
SCHEMBL14414468 0.84 CYP19A1 (0.56) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL30932257 0.83 CYP11B1 (0.67) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL28206073 0.83 CYP11B1 (0.67) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL14451615 0.82 CYP19A1 (0.50) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL28140204 0.76 CYP11B1 (0.68) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL12820071 0.75 CYP11B1 (0.48) CYP11B1CYP19A1CYP11B2
SCHEMBL1024261 0.75 CYP11B1 (0.84) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL9747476 0.75 CYP11B1 (0.66) CYP11B1CYP19A1CYP11B2
SCHEMBL15399684 0.74 CYP19A1 (0.87) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6
SCHEMBL11082155 0.74 CYP11B1 (1.00) CYP11B1CYP19A1CYP11B2CYP2A6CYP2B6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110003079-A For making the ligand of imaging cardiac innervation 兰休斯医疗成像公司 2019-07-12 CN disclosed
CN-105622463-B For making the ligand of imaging cardiac innervation 兰休斯医疗成像公司 2019-02-22 CN disclosed