SCHEMBL11096068

SCHEMBL11096068

CCNC(=O)c1cccc(Oc2cc(Cl)cc(OC)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.53
NR1H2 P55055 1/20 0.53
NR1H3 Q13133 1/20 0.53
MTNR1B P49286 1/20 0.51
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 3/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 2/20 0.49
TP53 P04637 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MMP13 P45452 1/20 0.49
HPGD P15428 2/20 0.48
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
RECQL P46063 1/20 0.47
DRD4 P21917 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL47353 0.84 MMP13 (0.66) NPC1RAB9AMAPTGAALMNA
SCHEMBL11668725 0.81 HDAC8 (0.67) NPC1RAB9ALMNASMN1; SMN2
SCHEMBL7799270 0.78 KDM4E (0.69) NPC1RAB9AMAPTGAASMN1; SMN2
SCHEMBL8736963 0.78 MMP13 (0.56) NR1H2NR1H3MTNR1BNPC1RAB9A
SCHEMBL11097066 0.78 PTGDR2 (0.54) SNCANR1H2NR1H3NPC1RAB9A
SCHEMBL2969396 0.76 L3MBTL1 (0.55) SNCANR1H2NR1H3MAPTLMNA
SCHEMBL5552356 0.76 NPC1 (0.60) NPC1RAB9ALMNATP53SMN1; SMN2
SCHEMBL3456293 0.75 L3MBTL1 (0.69) NR1H2NR1H3SMN1; SMN2DRD2
SCHEMBL4154673 0.75 ALDH1A1 (0.56) MAPTTP53SMN1; SMN2HPGDCYP1A2
SCHEMBL24628559 0.74 PGR (0.50) SMN1; SMN2CYP1A2CYP3A4CYP2D6

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
US-4435332-A POSTEMERGENCE, PREEMERGENCE HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-03-06 US disclosed
US-4263039-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-04-21 US disclosed
US-4173464-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-11-06 US disclosed