SCHEMBL6837460

SCHEMBL6837460

FC(F)(F)c1cccc(-c2ccc(C3CC3)c(-c3ccc(Cl)cc3)n2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.54
CTSS P25774 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
VCP P55072 1/20 0.41
MAOB P27338 1/20 0.41
KMO O15229 1/20 0.40
IDO1 P14902 1/20 0.39
LMNA P02545 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
XDH P47989 1/20 0.38
FAAH O00519 1/20 0.38
CNR2 P34972 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 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
SCHEMBL6837433 0.88 KDM1A (0.49) KDM1ACTSSMEN1KMT2APOLB
SCHEMBL528169 0.85 KDM1A (0.73) KDM1ACTSSKDM4EALDH1A1VCP
SCHEMBL15136574 0.85 KDM1A (0.73) KDM1ACTSSKDM4EALDH1A1VCP
SCHEMBL528168 0.85 KDM1A (0.73) KDM1ACTSSKDM4EALDH1A1VCP
Hydrochloric Acid SCHEMBL527621 0.84 KDM1A (0.71) KDM1ACTSSKDM4EALDH1A1VCP
Hydrochloric Acid SCHEMBL527622 0.84 KDM1A (0.71) KDM1ACTSSKDM4EALDH1A1VCP
SCHEMBL6837458 0.83 KDM1A (0.70) KDM1ACTSSMEN1KMT2APOLB
SCHEMBL20923959 0.79 KDM1A (0.70) KDM1ACTSSMEN1KMT2APOLB
SCHEMBL15135874 0.78 KDM1A (0.49) KDM1AMEN1KMT2AKDM4EALDH1A1
SCHEMBL528925 0.78 KDM1A (0.49) KDM1AMEN1KMT2AKDM4EALDH1A1

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-2598480-B1 CYCLOPROPYLAMINE DERIVATIVES USEFUL AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2019-04-24 EP disclosed
WO-2012013727-A1 CYCLOPROPYLAMINE DERIVATIVES USEFUL AS LSD1 INHIBITORS ORYZON GENOMICS S.A. (ES) 2012-02-02 WO disclosed