SCHEMBL230545

SCHEMBL230545

O=Cc1ccc(C(Cc2ccccc2)C(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 1/20 0.54
EPHX1 P07099 1/20 0.53
CYP1A2 P05177 1/20 0.47
SRR Q9GZT4 2/20 0.45
CYP2C19 P33261 1/20 0.45
PTGS1 P23219 2/20 0.44
ALPI P09923 1/20 0.44
PKM P14618 1/20 0.44
XIAP P98170 1/20 0.44
SLC7A5 Q01650 1/20 0.44
CPA1 P15085 2/20 0.44
PTGS2 P35354 1/20 0.44
CHRM1 P11229 3/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
UBE2N P61088 1/20 0.43
CPA3 P15088 1/20 0.42
FOLH1 Q04609 1/20 0.42

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
SCHEMBL599399 0.84 EPHX1 (0.71) P4HTMEPHX1CYP1A2SRRCYP2C19
SCHEMBL3079795 0.84 EPHX1 (0.71) P4HTMEPHX1CYP1A2SRRCYP2C19
SCHEMBL67234 0.84 EPHX1 (0.71) P4HTMEPHX1CYP1A2SRRCYP2C19
Hydrochloric Acid SCHEMBL933353 0.82 EPHX1 (0.69) P4HTMEPHX1CYP1A2SRRCYP2C19
SCHEMBL6201202 0.81 ALDH1A1 (0.46) EPHX1CYP1A2SRRPTGS1ALPI
SCHEMBL5156210 0.81 ESR1 (0.61) P4HTMEPHX1CYP1A2PTGS1ALPI
SCHEMBL4153500 0.79 P4HTM (0.56) P4HTMEPHX1CYP1A2SRRCYP2C19
SCHEMBL1150918 0.79 EPHX1 (0.61) P4HTMEPHX1CYP1A2SRRPTGS1
SCHEMBL22070724 0.79 P4HTM (0.56) P4HTMEPHX1CYP1A2PTGS1ALPI
SCHEMBL29152992 0.79 P4HTM (0.56) P4HTMEPHX1CYP1A2CYP2C19PTGS1

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-20120004315-A1 Selective Estrogen Receptor Modulator RADIUS HEALTH, INC. 2012-01-05 US disclosed
US-7960412-B2 Selective estrogen receptor modulator EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-06-14 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-20120004315-A1 Selective Estrogen Receptor Modulator ESR1, GPER1, ESR2 P4HTM 1596/4885EPHX1 1361/4885CYP1A2 992/4885

“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.