SCHEMBL9818141

SCHEMBL9818141

CC/C(C)=C(/C(=O)O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 7/20 0.50
CES2 O00748 6/20 0.50
MAPT P10636 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.42
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 4/20 0.41
DAO P14920 1/20 0.41

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
SCHEMBL8158420 1.00 CES1 (0.50) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL12242104 0.81 TSHR (0.47) CES1CES2MAPTSMN1; SMN2HPGD
SCHEMBL15313234 0.81 CES1 (0.44) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL27908851 0.81 CES1 (0.52) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL5698372 0.81 CES1 (0.52) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL9818176 0.81 CES1 (0.52) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL27713863 0.80 CES1 (0.47) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL10768795 0.80 CES1 (0.48) CES1CES2MAPTL3MBTL1MEN1
SCHEMBL28176751 0.80 CES1 (0.42) CES1CES2MAPTSMN1; SMN2L3MBTL1
SCHEMBL11483327 0.80 CES2 (0.57) CES1CES2MAPTL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4762948-A USING METALLOCENYL PHOSPHINE REDUCING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-09 US claimed
US-20190031591-A1 METHOD FOR PREPARING MULTI-SUBSTITUTED ACRYLIC ACID COMPOUND CHANG CHUN PLASTICS CO., LTD. (TW) 2019-01-31 US disclosed
EP-0275354-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE ARYLACETIC ACID DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-10-16 EP disclosed
US-4762948-A USING METALLOCENYL PHOSPHINE REDUCING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-09 US disclosed
EP-0275354-A1 Process for preparing optically active arylacetic acid derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-07-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190031591-A1 METHOD FOR PREPARING MULTI-SUBSTITUTED ACRYLIC ACID COMPOUND GRIA4, ASNS, GRIA1 CES1 3876/4885CES2 2964/4885MAPT 4448/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.