SCHEMBL31663168

SCHEMBL31663168

Cc1noc(-c2cc(C3CCN(C(=O)OC(C)(C)C)CC3)n[nH]2)c1C.Cc1noc(C(=O)CC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.39
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ IGF1R P08069 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ GPR119 Q8TDV5 2/20 0.36
▸ PTPN2 P17706 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ PTPN6 P29350 1/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ STS P08842 2/20 0.35

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
SCHEMBL31663336 0.84 RECQL (0.44) KMT2AMEN1STAT3HPGDGPR119
SCHEMBL31663205 0.72 HTT (0.53) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL31663054 0.71 HTT (0.52) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL31663414 0.70 HTT (0.57) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL20135048 0.69 HTT (0.50) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL31466315 0.68 CNR1 (0.58) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL20299835 0.68 HTT (0.54) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL1493280 0.68 HTT (0.54) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL15037238 0.67 HTT (0.64) HTTKDM4EMAPTTHRBKMT2A
SCHEMBL30968724 0.67 RECQL (0.45) KDM4EMAPTTHRBKMT2AHPGD

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
WO-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 — — WO disclosed
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