SCHEMBL18708205

SCHEMBL18708205

C=C(CNCc1cc(C(=O)OCC(F)(F)F)ccn1)N(CC)CCN(C)C

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 14/20 0.67
▸ KDM5C P41229 8/20 0.67
▸ KDM5A P29375 7/20 0.67
▸ KDM4C Q9H3R0 2/20 0.67
▸ KDM4A O75164 2/20 0.56
▸ KDM6B O15054 1/20 0.56
▸ KDM2B Q8NHM5 1/20 0.56
▸ KDM5D Q9BY66 1/20 0.56
▸ JMJD6 Q6NYC1 1/20 0.42
▸ HCRTR1 O43613 4/20 0.35
▸ HCRTR2 O43614 4/20 0.35
▸ NPC1 O15118 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL16291798 0.91 KDM5B (0.81) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18286846 0.84 KDM5B (0.80) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18708312 0.83 KDM5B (0.80) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL19676454 0.81 KDM5B (0.61) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16912742 0.81 KDM5B (0.56) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL16912741 0.81 KDM5B (0.56) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL18708207 0.81 KDM5B (0.58) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL19676423 0.81 KDM5B (0.54) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL15637431 0.80 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A
SCHEMBL29373338 0.80 KDM5B (1.00) KDM5BKDM5CKDM5AKDM4CKDM4A

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
EP-3023415-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2017-12-06 — — EP disclosed
EP-3150582-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. (US) 2017-04-05 — — EP disclosed
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