SCHEMBL5923935

SCHEMBL5923935

CCCC(CCC)NC(=O)Nc1ccc(Cl)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.70
TAS1R1 Q7RTX1 4/20 0.70
UBE2M P61081 1/20 0.53
DCUN1D1 Q96GG9 1/20 0.53
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 3/20 0.49
MAPK1 P28482 1/20 0.49
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
HTT P42858 1/20 0.48
USP2 O75604 1/20 0.48
HPGD P15428 1/20 0.48
GAA P10253 1/20 0.48
CNR1 P21554 1/20 0.47
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL5923925 0.87 TAS1R3 (0.68) TAS1R3TAS1R1RAB9ASMN1; SMN2LMNA
SCHEMBL703261 0.82 TAS1R3 (1.00) TAS1R3TAS1R1RAB9ASMN1; SMN2MAPK1
SCHEMBL12932744 0.80 MAPK1 (0.72) TAS1R3TAS1R1RAB9ASMN1; SMN2LMNA
SCHEMBL702263 0.79 TAS1R3 (0.60) TAS1R3TAS1R1RAB9ASMN1; SMN2LMNA
SCHEMBL21141308 0.78 TAS1R3 (0.55) TAS1R3TAS1R1RAB9ASMN1; SMN2LMNA
SCHEMBL11428179 0.78 LMNA (0.68) TAS1R3TAS1R1UBE2MDCUN1D1RAB9A
SCHEMBL5471126 0.78 RAB9A (0.65) RAB9ASMN1; SMN2HTTUSP2HPGD
SCHEMBL11428889 0.77 SMN1; SMN2 (0.67) TAS1R3TAS1R1UBE2MDCUN1D1RAB9A
SCHEMBL702395 0.76 TAS1R3 (1.00) TAS1R3TAS1R1RAB9ASMN1; SMN2LMNA
SCHEMBL5923905 0.75 MAPK1 (0.58) TAS1R3TAS1R1SMN1; SMN2LMNAMAPK1

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-20060045953-A1 Aromatic amides and ureas and their uses as sweet and/or umami flavor modifiers, tastants and taste enhancers SENOMYX, INC. 2006-03-02 US disclosed