SCHEMBL22756281

SCHEMBL22756281

CCOc1nc(OC2CCN(C(C)=O)CC2)ccc1C

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 1/20 0.52
▸ NAMPT P43490 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ IKBKB O14920 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.41
▸ CYP4F2 P78329 1/20 0.40
▸ CYP4A11 Q02928 1/20 0.40

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
SCHEMBL19329311 0.86 PRMT5 (0.57) PRMT5NAMPTMAPTIKBKBGPR119
SCHEMBL19329299 0.73 GPR119 (0.59) PRMT5MAPTGPR119
SCHEMBL15830041 0.71 PRMT5 (0.49) PRMT5NAMPTIKBKBCYP4F2CYP4A11
SCHEMBL31370464 0.71 NAMPT (0.57) NAMPTIKBKBGPR119CYP4F2CYP4A11
SCHEMBL21297230 0.71 PRMT5 (0.49) PRMT5NAMPTIKBKBCYP4F2CYP4A11
SCHEMBL15114919 0.69 NAMPT (0.45) PRMT5NAMPTIKBKBGPR119CYP4F2
SCHEMBL4263974 0.69 MAPT (0.38) MAPT
SCHEMBL21566655 0.69 GPR119 (0.44) PRMT5NAMPTIKBKBGPR119CYP4F2
SCHEMBL2094409 0.69 HRH3 (0.49) NAMPTIKBKBCYP4F2CYP4A11
SCHEMBL25113414 0.69 HRH3 (0.50) NAMPTIKBKBCYP4F2CYP4A11

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-3426351-B1 BENZOPIPERIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER AND HEMOGLOBINOPATHIES CTXT PTY LTD (AU) 2020-12-09 — — EP disclosed
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