SCHEMBL19676462

SCHEMBL19676462

O=C(O)c1ccnc(CCNCCC(O)CO)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4D Q6B0I6 3/20 0.42
▸ KDM5C P41229 8/20 0.40
▸ KDM4C Q9H3R0 4/20 0.40
▸ KDM5B Q9UGL1 9/20 0.39
▸ KDM4A O75164 5/20 0.39
▸ KDM5A P29375 4/20 0.39
▸ KDM6B O15054 4/20 0.39
▸ KDM2B Q8NHM5 1/20 0.39
▸ KDM4E B2RXH2 7/20 0.39
▸ KDM2A Q9Y2K7 3/20 0.39
▸ KDM3A Q9Y4C1 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TET3 O43151 1/20 0.39
▸ BBOX1 O75936 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ ASPH Q12797 1/20 0.39
▸ TET2 Q6N021 1/20 0.39
▸ ALKBH5 Q6P6C2 1/20 0.39
▸ KDM7A Q6ZMT4 1/20 0.39
▸ KDM8 Q8N371 1/20 0.39

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
SCHEMBL16310760 0.77 KDM5B (0.49) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL15636891 0.77 KDM5B (0.49) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL16291806 0.72 KDM5B (0.53) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL16055909 0.72 MAPK1 (0.47) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL2305108 0.70 KDM4C (0.57) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL16055756 0.70 KDM4E (0.65) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL481039 0.70 KDM4C (0.52) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL17144250 0.69 CYP2D6 (0.46) KDM5CKDM4CKDM5BKDM4AKDM5A
SCHEMBL31313383 0.68 GRIN2D (0.48) KDM4DKDM5CKDM4CKDM5BKDM4A
SCHEMBL7670706 0.67 KDM4C (0.57) KDM4DKDM5CKDM4CKDM5BKDM4A

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-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
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