SCHEMBL8118174

SCHEMBL8118174

O=CNc1ccccc1C(=O)OCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.58
▸ L3MBTL1 Q9Y468 4/20 0.58
▸ TSHR P16473 3/20 0.58
▸ TDP1 Q9NUW8 3/20 0.58
▸ NPC1 O15118 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ CYP3A4 P08684 2/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ TP53 P04637 1/20 0.58
▸ GLA P06280 1/20 0.58
▸ HPGD P15428 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ ESR1 P03372 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.47
▸ HCAR2 Q8TDS4 1/20 0.47
▸ CASP3 P42574 1/20 0.46
▸ SENP8 Q96LD8 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
SCHEMBL8123201 0.92 LMNA (0.50) ALDH1A1L3MBTL1TSHRTDP1NPC1
SCHEMBL2439121 0.85 ALDH1A1 (0.59) ALDH1A1L3MBTL1TSHRTDP1NPC1
SCHEMBL8120935 0.84 TSHR (0.66) ALDH1A1L3MBTL1TSHRTDP1RAB9A
SCHEMBL5540387 0.82 ALDH1A1 (0.65) ALDH1A1L3MBTL1TSHRTDP1RAB9A
SCHEMBL27903033 0.82 CASP3 (0.45) ALDH1A1L3MBTL1TSHRTDP1NPC1
SCHEMBL8115706 0.82 KDM4E (0.52) ALDH1A1L3MBTL1TSHRTDP1RAB9A
SCHEMBL290777 0.81 TSHR (0.77) ALDH1A1L3MBTL1TSHRTDP1NPC1
SCHEMBL8106862 0.80 TSHR (0.67) ALDH1A1L3MBTL1TSHRTDP1CYP3A4
SCHEMBL28329024 0.80 ALDH1A1 (0.62) ALDH1A1L3MBTL1TSHRTDP1NPC1
SCHEMBL5525906 0.79 CASP3 (0.64) ALDH1A1TSHRTDP1RAB9ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 — — US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 — — EP disclosed
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