SCHEMBL16474295

SCHEMBL16474295

C=Cc1cc(F)cc(C2CCCN2CC)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 3/20 0.34
▸ DRD2 P14416 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ LMNA P02545 2/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ OPRK1 P41145 1/20 0.30

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
SCHEMBL20340606 0.79 KDM4E (0.38) RIPK1DRD2LMNA
SCHEMBL19275745 0.74 RIPK1 (0.58) RIPK1LMNAOPRM1OPRD1OPRK1
SCHEMBL4301475 0.73 RIPK1 (0.43) RIPK1
SCHEMBL20349553 0.73 TRPA1 (0.49) MEN1KMT2ALMNAL3MBTL1
SCHEMBL22382687 0.72 JAK2 (0.50) DRD2
SCHEMBL18783105 0.70 LMNA (0.56) RIPK1LMNAOPRM1OPRD1OPRK1
SCHEMBL16429280 0.69 L3MBTL3 (0.40) DRD2
SCHEMBL16959745 0.69 NPY5R (0.30) —
SCHEMBL23491516 0.69 TRPA1 (0.44) MEN1KMT2ALMNAL3MBTL1
SCHEMBL19547178 0.68 RIPK1 (0.33) RIPK1LMNAOPRM1OPRD1OPRK1

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-2350071-B1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS TRK KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2014-01-08 — — EP disclosed
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