SCHEMBL257863

SCHEMBL257863

OBc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 7/20 0.57
▸ TSHR P16473 1/20 0.57
▸ NR1H2 P55055 1/20 0.56
▸ BAX Q07812 1/20 0.56
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ MAOA P21397 1/20 0.50
▸ PARP10 Q53GL7 1/20 0.47
▸ SRD5A2 P31213 1/20 0.45
▸ FFAR1 O14842 1/20 0.42
▸ IDH1 O75874 1/20 0.42
▸ GSTP1 P09211 1/20 0.42
▸ SOS1 Q07889 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ PLA2G2A P14555 1/20 0.42
▸ SMN1; SMN2 Q16637 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
Diphenylether SCHEMBL725398 0.82 LTA4H (0.75) LTA4HTSHRNR1H2BAXCA1
SCHEMBL9212518 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL11576945 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL22129853 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL3893562 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL122719 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL435149 0.79 LTA4H (0.92) LTA4HTSHRNR1H2BAXCA1
SCHEMBL10269852 0.78 ALDH1A1 (0.61) SMN1; SMN2
SCHEMBL12030611 0.78 LTA4H (0.60) LTA4HTSHRNR1H2BAXCA1
SCHEMBL410120 0.76 LTA4H (0.57) LTA4HTSHRNR1H2BAXCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023157030-A1 PROCESS FOR THE PREPARATION OF 1-(4-(((6-AMINO-5-(4-PHENOXYPHENYL)PYRIMIDIN-4-YL) AMINO)METHYL)PIPERIDIN-1-YL)PROP-2-EN-1-ONE MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2023-08-24 — — WO disclosed
US-11192865-B2 Benzosulfonyl compounds VIVACE THERAPEUTICS, INC. (US) 2021-12-07 — — US disclosed
CN-108780924-B Electrolyte containing magnesium ions 富士胶片和光纯药株式会社 2021-09-24 — — CN disclosed
US-20200354325-A1 BENZOSULFONYL COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-11-12 — — US disclosed
WO-2017156495-A1 COMPOUNDS AND METHODS FOR MODULATING BRUTON'S TYROSINE KINASE CORVUS PHARMACEUTICALS, INC. (US) 2017-09-14 — — WO disclosed
EP-3147285-A2 PURINONE COMPOUNDS AS KINASE INHIBITORS Pharmacyclics, Inc. (US) 2017-03-29 — — EP disclosed
EP-1292577-B1 ARYL SUBSTITUTED PYRAZOLES, TRIAZOLES AND TETRAZOLES AS SODIUM CHANNEL BLOCKER EURO CELTIQUE SA (LU) 2012-10-24 — — EP disclosed
EP-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
EP-2399584-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 — — EP disclosed
WO-2007092208-A1 PHOTOTHERMOGRAPHIC MATERIALS INCORPORATING ARYLBORONIC ACIDS CARESTREAM HEALTH, INC. (US) 2007-08-16 — — WO 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 (2 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-11192865-B2 Benzosulfonyl compounds YAP1, TEAD2, TEAD1 LTA4H 4251/4885TSHR 3362/4885NR1H2 701/4885
US-20200354325-A1 BENZOSULFONYL COMPOUNDS YAP1, TEAD2, TEAD1 LTA4H 4251/4885TSHR 3362/4885NR1H2 701/4885

“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.

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