SCHEMBL19057972

SCHEMBL19057972

CCNc1ccc(Oc2ccc(F)cc2C#N)cc1C=N

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 6/20 0.42
▸ SLC22A12 Q96S37 11/20 0.38
▸ PLA2G7 Q13093 1/20 0.38
▸ HTR2A P28223 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GAA P10253 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
SCHEMBL19057964 0.87 AR (0.41) ARSLC22A12PLA2G7
SCHEMBL14437176 0.86 PLA2G7 (0.41) ARSLC22A12PLA2G7
SCHEMBL14435933 0.83 PLA2G7 (0.53) ARSLC22A12PLA2G7
SCHEMBL14437173 0.81 AR (0.52) ARSLC22A12PLA2G7POLBGAA
SCHEMBL19057971 0.79 AR (0.47) ARSLC22A12PLA2G7KCNH2POLB
SCHEMBL5949965 0.72 AR (0.56) ARSLC22A12PLA2G7POLBGAA
SCHEMBL17407526 0.72 AR (0.50) ARSLC22A12HTR2ASLC6A4KCNH2
SCHEMBL15994257 0.69 AR (0.47) ARSLC22A12PLA2G7KCNH2
SCHEMBL4103326 0.69 HTR2A (0.53) ARSLC22A12HTR2ASLC6A4POLB
SCHEMBL13924849 0.68 SLC6A4 (0.46) HTR2ASLC6A4KCNH2

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
EP-2961744-B1 INTERMEDIATES FOR USE IN THE PREPARATION OF INDAZOLE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF ARRAY BIOPHARMA INC (US) 2017-06-28 — — EP disclosed
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