SCHEMBL18880299

SCHEMBL18880299

CN(C)CCNCc1ccnc(CNCN(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM5C P41229 6/20 0.43
▸ KDM5B Q9UGL1 6/20 0.43
▸ SIRT2 Q8IXJ6 3/20 0.40
▸ TERT O14746 2/20 0.40
▸ KDM5A P29375 5/20 0.40
▸ KDM6B O15054 1/20 0.40
▸ KDM4A O75164 1/20 0.40
▸ KDM2B Q8NHM5 1/20 0.40
▸ VSIR Q9H7M9 2/20 0.40
▸ KDM4C Q9H3R0 2/20 0.39
▸ KDM5D Q9BY66 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ BRAF P15056 1/20 0.38
▸ PDGFRB P09619 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ CCNA2 P20248 1/20 0.36
▸ CDK2 P24941 1/20 0.36

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
SCHEMBL15994111 0.81 KDM5B (0.56) KDM5CKDM5BKDM5AKDM6BKDM4A
SCHEMBL19582240 0.80 TERT (0.43) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL16293301 0.79 HRH4 (0.40) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL16293030 0.79 TMEM97 (0.56) KDM5BSIRT2TERTVSIRCCNA2
SCHEMBL19582224 0.77 NOS3 (0.49) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL16293691 0.77 KDM5B (0.43) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL16305525 0.75 TERT (0.44) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL18860200 0.75 SIRT2 (0.41) KDM5CKDM5BSIRT2TERTKDM5A
SCHEMBL16293032 0.75 SIRT2 (0.40) KDM5CKDM5BSIRT2TERTKDM4A
SCHEMBL17984955 0.75 SIRT2 (0.39) KDM5CKDM5BSIRT2TERTKDM5A

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-3170811-A1 ETHYL PYRIDINE-4-CARBOXYLATE COMPOUND AS INHIBITOR OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-05-24 — — EP disclosed
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