SCHEMBL20924166

SCHEMBL20924166

COc1cc(F)cc(-c2ccc(C3CC3)cn2)c1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 12/20 0.71
ROCK2 O75116 3/20 0.42
GRM5 P41594 1/20 0.41
LDHA P00338 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
DHODH Q02127 1/20 0.38

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
SCHEMBL20923991 0.84 KDM1A (0.71) KDM1AGRM5NPC1RAB9A
SCHEMBL6837416 0.83 KDM1A (1.00) KDM1A
SCHEMBL527719 0.83 KDM1A (1.00) KDM1A
SCHEMBL20924215 0.83 KDM1A (0.73) KDM1ADHODH
SCHEMBL527718 0.83 KDM1A (1.00) KDM1A
Hydrochloric Acid SCHEMBL15137188 0.82 KDM1A (0.98) KDM1A
Hydrochloric Acid SCHEMBL15137187 0.82 KDM1A (0.98) KDM1A
SCHEMBL20924173 0.81 KDM1A (0.70) KDM1ADHODH
SCHEMBL18923960 0.81 KDM1A (0.73) KDM1AGRM5NPC1RAB9A
SCHEMBL20924260 0.80 RXFP1 (0.51) KDM1ANPC1RAB9ACYP11B1

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-2598480-B1 CYCLOPROPYLAMINE DERIVATIVES USEFUL AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2019-04-24 EP disclosed