SCHEMBL27980653

SCHEMBL27980653

CCCCCCC(C)(Oc1ccccc1O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 12/20 0.50
CNR2 P34972 12/20 0.50
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 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
SCHEMBL27980996 0.99 CNR1 (0.48) CNR1CNR2
SCHEMBL27980771 0.94 CNR1 (0.43) CNR1CNR2MEN1MAPTKMT2A
SCHEMBL1581689 0.79 ALDH1A1 (0.46) CNR1CNR2MEN1ALDH1A1KMT2A
SCHEMBL8971230 0.79 ALDH1A1 (0.46) CNR1CNR2MEN1ALDH1A1KMT2A
SCHEMBL28944297 0.78 CNR2 (0.40) CNR1CNR2MEN1KMT2A
SCHEMBL1581716 0.78 MAPK1 (0.42) CNR1CNR2MEN1KMT2A
SCHEMBL1581356 0.78 MAPK1 (0.42) CNR1CNR2MEN1KMT2A
SCHEMBL27998616 0.77 ALDH1A1 (0.47) CNR1CNR2MEN1ALDH1A1KMT2A
SCHEMBL148644 0.76 CNR1 (0.45) CNR1CNR2MAPT
SCHEMBL10958323 0.75 SCN5A (0.45) CNR1CNR2MEN1ALDH1A1MAPT

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
CN-102471244-B Process for producing N-substituted carbamate, process for producing isocyanate using the N-substituted carbamate, and composition for transporting and storing N-substituted carbamate containing N-substituted carbamate and aromatic hydroxy compound ASAHI CHEMICAL CORP 2014-09-24 CN disclosed