SCHEMBL10565232

SCHEMBL10565232

CNC(N)(Cc1ccccc1)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 7/20 0.49
LMNA P02545 1/20 0.47
CYP2D6 P10635 1/20 0.47
SLC6A2 P23975 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HIF1A Q16665 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP2C19 P33261 1/20 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
Hydrochloric Acid SCHEMBL9582360 0.98 KIF11 (0.48) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL9001666 0.89 LMNA (0.53) KIF11LMNACYP2D6SLC6A2TAAR1
Hydrochloric Acid SCHEMBL9582771 0.87 LMNA (0.52) KIF11LMNACYP2D6SLC6A2TAAR1
Hydrochloric Acid SCHEMBL9001665 0.87 LMNA (0.52) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL9583362 0.85 KIF11 (0.48) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL9583254 0.82 LTA4H (0.51) KIF11LMNACYP2D6SLC6A2TAAR1
Hydrochloric Acid SCHEMBL9582712 0.81 LTA4H (0.50) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL5308339 0.77 SLC6A2 (0.55) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL9582846 0.76 LMNA (0.47) KIF11LMNACYP2D6SLC6A2TAAR1
SCHEMBL9583586 0.75 KIF11 (0.43) KIF11LMNACYP2D6SLC6A2TAAR1

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-4822914-A 2-amino-N-methyl-α-phenyl-phenethylamines HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-04-18 US claimed