SCHEMBL11233694

SCHEMBL11233694

Cc1ccc(O)c(C(=O)OCC=Cc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.60
▸ CACNA1B Q00975 7/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ MMP2 P08253 1/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP12 P39900 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ CSNK2A1 P68400 1/20 0.47
▸ KLF10 Q13118 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ACLY P53396 1/20 0.46
▸ CA12 O43570 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
SCHEMBL11235978 0.91 KMT2A (0.52) EGFRCACNA1BMMP1MMP2MMP9
SCHEMBL28158149 0.84 EGFR (0.57) EGFRCACNA1BMMP1MMP2MMP9
SCHEMBL28894463 0.84 EGFR (0.57) EGFRCACNA1BMMP1MMP2MMP9
SCHEMBL7672671 0.79 CYP3A4 (0.56) EGFRALDH1A1MAPTCSNK2A1KLF10
SCHEMBL11229669 0.78 MMP1 (0.52) EGFRCACNA1BL3MBTL1MMP1MMP2
SCHEMBL5695937 0.77 TDP1 (0.67) EGFRL3MBTL1ALDH1A1TDP1CSNK2A1
SCHEMBL1129358 0.76 CYP3A4 (0.57) EGFRCACNA1BMMP1MMP2MMP9
SCHEMBL1641611 0.76 CA12 (0.74) EGFRALDH1A1MAPTSMN1; SMN2CSNK2A1
SCHEMBL5132344 0.75 HSD17B2 (0.59) EGFRCACNA1BALDH1A1MAPTRECQL
SCHEMBL5132345 0.75 HSD17B2 (0.59) EGFRCACNA1BALDH1A1MAPTRECQL

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-4317917-A ANTIINFLAMMATORY, ANALGESIC, ANTIBACTERIAL AUSONIA FARMACEUTICI S.R.L. (IT) 1982-03-02 — — US disclosed
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