SCHEMBL9736097

SCHEMBL9736097

COC(=O)c1ccnc(CN2CCCC2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 3/20 0.54
▸ KDM5C P41229 2/20 0.54
▸ KDM4E B2RXH2 6/20 0.51
▸ KDM6B O15054 1/20 0.51
▸ KDM2A Q9Y2K7 1/20 0.51
▸ KDM3A Q9Y4C1 1/20 0.51
▸ JMJD6 Q6NYC1 1/20 0.49
▸ WNT1 P04628 1/20 0.48
▸ DYRK1A Q13627 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CASP1 P29466 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CHKA P35790 1/20 0.44
▸ KDM5B Q9UGL1 2/20 0.44

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
SCHEMBL1287025 0.88 KDM5C (0.51) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL17144910 0.85 JMJD6 (0.42) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL1287113 0.83 NPC1 (0.45) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL2305288 0.82 KDM4C (0.76) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL1287029 0.81 KDM4C (0.44) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL16291774 0.81 KDM4C (0.74) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL6017370 0.81 ALDH1A1 (0.47) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL15636986 0.80 SMYD2 (0.46) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL15636461 0.80 KDM4C (0.76) KDM4CKDM5CKDM4EKDM6BKDM2A
SCHEMBL1286996 0.79 KDM4C (0.44) KDM4CKDM5CKDM4EKDM6BKDM2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5114945-A Spiropiperidine derivatives GLAXO GROUP LIMITED (GB) 1992-05-19 — — US disclosed
EP-0330461-A2 Piperidine derivatives GLAXO GROUP LIMITED (GB) 1989-08-30 — — EP disclosed
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