SCHEMBL28776715

SCHEMBL28776715

CC1(C)Cc2ccccc2C1(N)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.38
KDM1A O60341 1/20 0.37
PDK2 Q15119 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
Hydrochloric Acid SCHEMBL2388798 0.98 HTR2A (0.37) HTR2AKDM1APDK2MEN1KMT2A
SCHEMBL2390411 0.75 HTR2A (0.44) HTR2AKDM1ASIGMAR1
SCHEMBL27511998 0.75 HTR2A (0.44) HTR2AKDM1ASIGMAR1
Hydrochloric Acid SCHEMBL2386732 0.73 HTR2A (0.42) HTR2AKDM1ASIGMAR1
SCHEMBL12745139 0.72 HTR2A (0.40) HTR2AKDM1AMEN1KMT2A
SCHEMBL9053415 0.72 HTR2A (0.41) HTR2AKDM1ASIGMAR1
SCHEMBL2354334 0.70 HTR2A (0.42) HTR2AKDM1ASIGMAR1
SCHEMBL2389396 0.69 KDM1A (0.41) HTR2AKDM1ASIGMAR1
SCHEMBL2389607 0.69 HTR2A (0.43) HTR2AKDM1AKMT2A
SCHEMBL2389059 0.69 HTR2A (0.39) HTR2AKDM1AMEN1KMT2ASIGMAR1

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
CN-101489984-B Aminoindan derivative or salt thereof ASTELLAS PHARMA INC 2013-04-03 CN disclosed
CN-101489984-A Aminoindan derivative or salt thereof ASTELLAS PHARMA INC (JP) 2009-07-22 CN disclosed