SCHEMBL23654079

SCHEMBL23654079

CCCCCN(CC)c1cc(-c2cc(NC)ccc2C)ccc1CCCC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.33
BRAF P15056 1/20 0.31
CRHR1 P34998 1/20 0.31
RARA P10276 2/20 0.31
RARB P10826 2/20 0.31
RARG P13631 2/20 0.31

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
SCHEMBL23654070 0.68 S1PR1 (0.31) BRAF
SCHEMBL23473667 0.68 TYR (0.39)
SCHEMBL20654547 0.65 ICMT (0.35) IDO1
SCHEMBL23864401 0.65 CTRC (0.41)
SCHEMBL25039667 0.65 CNR2 (0.41)
SCHEMBL20008143 0.65 BRAF (0.38) BRAF
SCHEMBL23654081 0.64 RARA (0.32) RARARARBRARG
SCHEMBL10490516 0.62 ALDH1A1 (0.40)
SCHEMBL31495953 0.62 LIPG (0.40) CRHR1
SCHEMBL25270983 0.60 ALDH1A1 (0.51) CRHR1

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-3390404-B1 TRICYCLIC COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS NOVARTIS AG (CH) 2021-07-21 EP disclosed