SCHEMBL8095568

SCHEMBL8095568

CCCCCc1cc(Cc2cccc(C)c2)ccc1Cc1cccc(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.49
CNR2 P34972 2/20 0.49
TLR8 Q9NR97 3/20 0.42
TAAR1 Q96RJ0 1/20 0.41
MAPT P10636 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
RAD52 P43351 2/20 0.39
KDM4E B2RXH2 1/20 0.39
APAF1 O14727 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
LPL P06858 2/20 0.39
LIPG Q9Y5X9 2/20 0.39
LTA4H P09960 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
MEN1 O00255 2/20 0.37
HTT P42858 2/20 0.37

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
SCHEMBL8102084 0.98 CNR1 (0.48) CNR1CNR2TLR8TAAR1MAPT
SCHEMBL8094871 0.98 CNR1 (0.48) CNR1CNR2TLR8TAAR1MAPT
SCHEMBL8087103 0.98 CNR1 (0.48) CNR1CNR2TLR8TAAR1MAPT
SCHEMBL8087092 0.96 CNR1 (0.46) CNR1CNR2TLR8TAAR1LTA4H
SCHEMBL8099907 0.95 CNR1 (0.44) CNR1CNR2TLR8TAAR1MAPT
SCHEMBL8086350 0.94 CNR1 (0.46) CNR1CNR2TLR8LPLLIPG
SCHEMBL8099736 0.94 CNR1 (0.46) CNR1CNR2TLR8LPLLIPG
SCHEMBL8099834 0.94 CNR1 (0.46) CNR1CNR2TLR8LPLLIPG
SCHEMBL8095605 0.91 CNR1 (0.42) CNR1CNR2TLR8TAAR1POLB
SCHEMBL8101879 0.90 CNR1 (0.48) CNR1CNR2TLR8TAAR1LPL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed