SCHEMBL11032147

SCHEMBL11032147

C=CCOCC(O)CNc1ccc(C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
ADRB2 P07550 2/20 0.44
ADRB1 P08588 2/20 0.44
ADRB3 P13945 2/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
HTT P42858 1/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA7 P43166 3/20 0.41
ABCB1 P08183 2/20 0.39
CA4 P22748 2/20 0.38
CA9 Q16790 2/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
FFAR1 O14842 1/20 0.37
CSNK2A2 P19784 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
SCHEMBL11035087 0.85 FFAR1 (0.55) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL529792 0.82 MAPT (0.54) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL11035611 0.80 CA1 (0.48) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL11033804 0.76 ALDH1A1 (0.43) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL1664315 0.75 FNTA (0.53) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL11546865 0.72 MAPT (0.61) MAPTSMN1; SMN2HTTALDH1A1
SCHEMBL11548347 0.72 MAPT (0.61) MAPTSMN1; SMN2HTTALDH1A1
SCHEMBL529794 0.72 MAPT (0.44) MAPTSMN1; SMN2ADRB2ADRB1ADRB3
SCHEMBL10335955 0.71 GRIA4 (0.42) MAPTSMN1; SMN2NPC1RAB9AHTT
SCHEMBL11031254 0.71 CA1 (0.42) MAPTSMN1; SMN2ADRB2ADRB1ADRB3

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-4468493-A High solid coating composition containing novel microparticles of crosslinked copolymer containing amphoionic groups NIPPON PAINT CO., LTD. (JP) 1984-08-28 US disclosed
US-4403065-A CARBOXY OR SULFONATE AMINE AND OTHER MONOMER NIPPON PAINT CO., LTD. (JP) 1983-09-06 US disclosed
US-4309327-A COATINGS, PIGMENT PASTES NIPPON PAINT CO., LTD. (JP) 1982-01-05 US disclosed