SCHEMBL25923931

SCHEMBL25923931

CC(C)(O)CN1CCC2(CC1)CC(NC1CC1)C2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 2/20 0.33
KDM1A O60341 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL20107004 0.85 KDM1A (0.30) KDM1A
SCHEMBL21088867 0.82 HTR4 (0.35) HTR4KDM1A
SCHEMBL21349212 0.81 KDM1A (0.39) HTR4KDM1A
SCHEMBL25923906 0.76 KDM1A (0.46) KDM1A
SCHEMBL25923937 0.73 KDM1A (0.40) KDM1ACYP1A2CYP2D6ALOX15
SCHEMBL21088467 0.73 CNR1 (0.37) KDM1A
SCHEMBL23019227 0.72 CYP1A2 (0.38) CYP1A2CYP2D6ALOX15
SCHEMBL24940732 0.72 KMT2A (0.31) KDM1A
SCHEMBL25923925 0.72 KDM1A (0.42) HTR4KDM1ACYP1A2CYP2D6ALOX15
SCHEMBL21088586 0.71 KDM1A (0.31) KDM1A

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-3532459-B1 LSD1 INHIBITORS AND MEDICAL USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2023-08-02 EP disclosed