SCHEMBL8945298

SCHEMBL8945298

CCCCCCC1(c2ccccc2Cc2ccc(N)cc2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.39
CNR2 P34972 4/20 0.39
CYP19A1 P11511 6/20 0.37
CETP P11597 3/20 0.37
SLC6A4 P31645 3/20 0.37
SLC6A2 P23975 3/20 0.35
SLC6A3 Q01959 3/20 0.35
GPR55 Q9Y2T6 2/20 0.35
HDAC4 P56524 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
SCHEMBL8945190 1.00 CNR1 (0.39) CNR1CNR2CYP19A1CETPSLC6A4
SCHEMBL8945495 1.00 CNR1 (0.39) CNR1CNR2CYP19A1CETPSLC6A4
SCHEMBL8575971 0.99 SLC6A4 (0.38) CNR1CNR2CYP19A1CETPSLC6A4
SCHEMBL8578897 0.95 CNR2 (0.38) CNR1CNR2CYP19A1CETPSLC6A4
SCHEMBL8578668 0.90 SLC6A4 (0.37) CETPSLC6A4SLC6A2SLC6A3HDAC4
SCHEMBL8944988 0.85 SKP2 (0.42) CNR1CNR2CETPSLC6A4SLC6A2
SCHEMBL8945573 0.85 SKP2 (0.42) CNR1CNR2CETPSLC6A4SLC6A2
SCHEMBL8945402 0.85 SKP2 (0.42) CNR1CNR2CETPSLC6A4SLC6A2
SCHEMBL8468662 0.84 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3HDAC4
SCHEMBL8945342 0.84 SKP2 (0.43) CNR1CNR2CETPSLC6A4SLC6A2

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
US-5501884-A Diamino compounds and their production method and liquid crystal alignment layers using the compounds CHISSO CORPORATION (JP) 1996-03-26 US disclosed