SCHEMBL7512255

SCHEMBL7512255

CCC(C(=O)O)N(Cc1ccccc1)Cc1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.55
TDP1 Q9NUW8 2/20 0.51
MAPK1 P28482 1/20 0.50
LDHA P00338 1/20 0.50
PPARG P37231 1/20 0.50
PPARA Q07869 1/20 0.50
TSHR P16473 1/20 0.49
PTGES O14684 1/20 0.48
TAS2R14 Q9NYV8 1/20 0.48
TAS2R8 Q9NYW2 1/20 0.48
CXCR3 P49682 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
LTA4H P09960 1/20 0.47
EPOR P19235 1/20 0.47

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
SCHEMBL31062607 0.89 LDHA (0.58) ACHETDP1MAPK1LDHAPPARG
SCHEMBL842374 0.88 LMNA (0.49) MEN1KMT2A
SCHEMBL841079 0.88 LMNA (0.49) MEN1KMT2A
SCHEMBL11834013 0.82 ACHE (0.53) ACHETDP1MAPK1LDHAPPARG
SCHEMBL28162835 0.82 LMNA (0.50) MAPK1TSHRMEN1KMT2A
SCHEMBL5434326 0.80 PGR (0.51) ACHEMAPK1PPARGPPARATSHR
SCHEMBL27843715 0.79 ALOX5 (0.52) ACHETDP1MAPK1PPARGPPARA
SCHEMBL27843714 0.79 ALOX5 (0.52) ACHETDP1MAPK1PPARGPPARA
SCHEMBL5428157 0.79 LPAR1 (0.59) EPOR
SCHEMBL3854880 0.79 EPOR (0.54) MEN1KMT2AEPOR

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-20020147334-A1 Vitronectin Receptor Antagonists SMITHKLINE BEECHAM CORPORATION 2002-10-10 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-20020147334-A1 Vitronectin Receptor Antagonists ADGRF1, FN1, CALCR ACHE 3149/4885TDP1 4601/4885MAPK1 1097/4885

“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.