SCHEMBL21320705

SCHEMBL21320705

N#CCC1(N2CCC(C(F)(F)F)CC2)CNC1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 10/20 0.45
JAK1 P23458 1/20 0.32

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
SCHEMBL28465816 0.79 KDM1A (0.48) KDM1AJAK1
SCHEMBL21320562 0.76 KDM1A (0.62) KDM1A
SCHEMBL21320882 0.72 KDM1A (0.43) KDM1AJAK1
SCHEMBL19953566 0.71 KDM1A (0.41) KDM1A
Trifluoroacetic Acid SCHEMBL29187324 0.70 KDM1A (0.37) KDM1AJAK1
Hydrochloric Acid SCHEMBL21775423 0.68 KDM1A (0.41) KDM1AJAK1
SCHEMBL21784366 0.67 KDM1A (0.38) KDM1AJAK1
SCHEMBL12384757 0.66 CYP1A2 (0.35) KDM1A
SCHEMBL19566972 0.64 IRAK4 (0.30)
Hydrochloric Acid SCHEMBL31491288 0.63 JAK2 (0.37) JAK1

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-3105226-B1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS INCYTE CORP (US) 2019-09-04 EP disclosed