SCHEMBL16867367

SCHEMBL16867367

CC1(c2ccccc2C2(N)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
HTR2A P28223 1/20 0.36

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
SCHEMBL6552316 0.85 HTR2A (0.39) KDM1AHTR2A
SCHEMBL2336569 0.74 HDAC4 (0.43)
SCHEMBL30344393 0.74 HDAC4 (0.43)
SCHEMBL28531121 0.74 ALDH1A1 (0.39) KDM1AHTR2A
SCHEMBL13280780 0.74 CYP3A4 (0.41) KDM1AHTR2A
SCHEMBL14197705 0.74 KDM1A (0.35) KDM1A
SCHEMBL11804925 0.73 SLC6A2 (0.39)
SCHEMBL26027089 0.73 HTR2A (0.32) KDM1AHTR2A
Hydrochloric Acid SCHEMBL18742513 0.73 CYP3A4 (0.46)
SCHEMBL725435 0.71 ALDH1A1 (0.43) HTR2A

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
WO-2015095952-A1 VAR2CSA-DRUG CONJUGATES THE CENTRE FOR DRUG RESEARCH AND DEVELOPMENT (CA) 2015-07-02 WO disclosed