SCHEMBL817508

SCHEMBL817508

CC(CC=O)c1ccco1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
ALOX5 P09917 1/20 0.40
KMT2A Q03164 6/20 0.38
POLB P06746 4/20 0.38
PKM P14618 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPN7 P35236 1/20 0.38
BLM P54132 1/20 0.38
ESR2 Q92731 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
HPGD P15428 4/20 0.36
ATM Q13315 1/20 0.35
HSD17B10 Q99714 3/20 0.35
AGTR1 P30556 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 2/20 0.35

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
SCHEMBL13655743 0.80 ALDH1A1 (0.54) ALDH1A1ALOX5KMT2APOLBPKM
SCHEMBL18500255 0.77 ALDH1A1 (0.38) ALDH1A1ALOX5KMT2APOLBPKM
SCHEMBL6017360 0.76 OPRM1 (0.49) ALDH1A1KMT2APOLBMEN1KDM4E
SCHEMBL8245610 0.74
SCHEMBL826815 0.74
SCHEMBL10975719 0.74
SCHEMBL13881159 0.74
SCHEMBL13592482 0.72
SCHEMBL10618802 0.72
SCHEMBL11363504 0.72

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-7897795-B2 Process for the preparation of prostaglandin analogues and intermediates thereof SCINOPHARM TAIWAN LTD. (TW) 2011-03-01 US disclosed
US-20090259058-A1 Process for the Preparation of Prostaglandin Analogues and Intermediates Thereof SCINOPHARM TAIWAN LTD. 2009-10-15 US 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-20090259058-A1 Process for the Preparation of Prostaglandin Analogues and Intermediates Thereof PTGIS, PTGES, PTGER1 ALDH1A1 965/4885ALOX5 25/4885KMT2A 4674/4885

“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.