SCHEMBL1834420

SCHEMBL1834420

C[C@H](O)c1cc(F)cc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 3/20 0.43
TRPM8 Q7Z2W7 1/20 0.40
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
GPR139 Q6DWJ6 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.34
KCNH2 Q12809 1/20 0.33
APP P05067 2/20 0.33
MDM2 Q00987 1/20 0.33
UGT2B7 P16662 1/20 0.32
SLC6A2 P23975 1/20 0.32
PDE2A O00408 1/20 0.32
GRN P28799 1/20 0.31
SORT1 Q99523 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30
ACLY P53396 1/20 0.30

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
SCHEMBL1835863 1.00 EPAS1 (0.43) EPAS1TRPM8GABRA1GABRB1CES2
SCHEMBL1154665 0.84 CES2 (0.46) EPAS1TRPM8CES2CES1UGT2B7
SCHEMBL16094124 0.84 TSHR (0.44) EPAS1GABRA1GABRB1APPUGT2B7
SCHEMBL19667846 0.84 GABRA1 (0.42) EPAS1GABRA1GABRB1KCNH2UGT2B7
SCHEMBL9027044 0.84 TSHR (0.44) EPAS1GABRA1GABRB1APPUGT2B7
SCHEMBL11898232 0.84 TSHR (0.44) EPAS1GABRA1GABRB1APPUGT2B7
SCHEMBL4094087 0.84 CES2 (0.46) EPAS1TRPM8CES2CES1UGT2B7
SCHEMBL1321039 0.84 CES2 (0.46) EPAS1TRPM8CES2CES1UGT2B7
SCHEMBL4547915 0.82 TRPM8 (0.38) EPAS1TRPM8GABRA1GABRB1GPR139
SCHEMBL20868259 0.80 RAPGEF4 (0.39) EPAS1TRPM8GABRA1GABRB1GPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111212830-B N- (substituted sulfonyl) benzamide derivative and preparation method and medical application thereof 浙江海正药业股份有限公司 2023-07-04 CN disclosed
CN-111212830-A N- (substituted sulfonyl) benzamide derivative and preparation method and medical application thereof 浙江海正药业股份有限公司 2020-05-29 CN disclosed
WO-2019062848-A1 N-(SUBSTITUTED SULFONYL)BENZAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF 浙江海正药业股份有限公司 2019-04-04 WO disclosed
EP-2321287-B1 4,5-DIHYDRO-OXAZOL-2-YL DERIVATIVES HOFFMANN LA ROCHE (CH) 2015-11-11 EP disclosed
US-8729113-B2 4,5-dihydro-oxazol-2yl derivatives HOFFMANN-LA ROCHE INC. (US) 2014-05-20 US disclosed
US-8357712-B2 2013-01-22 US disclosed
US-8242153-B2 4,5-dihydro-oxazol-2YL derivatives HOFFMANN-LA ROCHE INC. (US) 2012-08-14 US disclosed
US-20120165294-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES GALLEY GUIDO (DE) 2012-06-28 US disclosed
US-20110144333-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES GALLEY GUIDO 2011-06-16 US disclosed
CN-102083805-A 4, 5-dihydro-oxazol-2-yl derivs HOFFMANN LA ROCHE 2011-06-01 CN disclosed
EP-2321287-A1 4,5-DIHYDRO-OXAZOL-2-YL DERIVATIVES F. Hoffmann-La Roche AG (CH) 2011-05-18 EP disclosed
US-20100041686-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES HOFFMANN-LA ROCHE, INC. 2010-02-18 US disclosed
US-20100029589-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES HOFFMANN-LA ROCHE INC. 2010-02-04 US disclosed
WO-2010010014-A1 4,5-DIHYDRO-OXAZOL-2-YL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-01-28 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 (4 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-20110144333-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES NPY5R, NPY1R, NPY4R EPAS1 1124/4885TRPM8 940/4885GABRA1 184/4885
US-20100029589-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES NPY5R, NPY1R, NPY4R EPAS1 1124/4885TRPM8 940/4885GABRA1 184/4885
US-20100041686-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES NPY5R, NPY1R, NPY4R EPAS1 1124/4885TRPM8 940/4885GABRA1 184/4885
US-20120165294-A1 4,5-DIHYDRO-OXAZOL-2YL DERIVATIVES NPY5R, NPY1R, NPY4R EPAS1 1124/4885TRPM8 940/4885GABRA1 184/4885

“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.