SCHEMBL365755

SCHEMBL365755

Oc1ccc(Cl)cc1OC(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 5/20 0.48
▸ HSD17B10 Q99714 4/20 0.45
▸ TSHR P16473 2/20 0.45
▸ P2RX1 P51575 3/20 0.44
▸ HPGD P15428 4/20 0.42
▸ ALOX15 P16050 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ ALOX12 P18054 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ TMEM97 Q5BJF2 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ HSP90AA1 P07900 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ HIF1A Q16665 2/20 0.41

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
SCHEMBL6445432 0.83 HSD17B10 (0.41) APPHSD17B10TSHRP2RX1HPGD
SCHEMBL6441902 0.83 MAPT (0.46) APPHSD17B10TSHRP2RX1HPGD
SCHEMBL3137556 0.79 TSHR (0.42) APPHSD17B10TSHRP2RX1HPGD
SCHEMBL7931554 0.79 EPAS1 (0.42) CNR2KCNH2IDO1
SCHEMBL8778326 0.79 MAOB (0.54) APPHSD17B10P2RX1ALOX15ALDH1A1
SCHEMBL2097133 0.78 APP (0.49) APPP2RX1KCNH2TMEM97SIGMAR1
SCHEMBL14121378 0.78 APP (0.49) APPP2RX1KCNH2TMEM97SIGMAR1
SCHEMBL4849499 0.78 APP (0.49) APPHSD17B10TSHRHPGDALOX15
SCHEMBL13319145 0.76 EPAS1 (0.44) TSHRSMN1; SMN2CNR2KCNH2CYP3A4
SCHEMBL213780 0.76 MAOA (0.49) APPHPGDALOX15ALOX12SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 — — EP disclosed
EP-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 — — EP disclosed
US-8604065-B2 Pyridyl cyanoguanidine derivatives Zhang, Hesheng (CN) 2013-12-10 — — US disclosed
EP-2593427-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN Pfizer Limited (GB) 2013-05-22 — — EP disclosed
WO-2013029338-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-03-07 — — WO disclosed
US-20120309797-A1 PYRIDYL CYANOGUANIDINE DERIVATIVES TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2012-12-06 — — US disclosed
WO-2012007883-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LIMITED (GB) 2012-01-19 — — WO disclosed
WO-2012007883-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LIMITED (GB) 2012-01-19 — — WO disclosed
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 — — US disclosed
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 — — US disclosed
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 — — US disclosed
CN-1738794-B Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY 2010-12-22 — — CN disclosed
CN-1738794-A Biguanide and dihydrotriazine derivatives JACOBUS PHARMACEUTICAL COMPANY (US) 2006-02-22 — — CN 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-20120010207-A1 Chemical Compounds SCN1A, SCN1B, SCN7A APP 2523/4885HSD17B10 2861/4885TSHR 2473/4885
US-20120309797-A1 PYRIDYL CYANOGUANIDINE DERIVATIVES PNPO, XDH, PDXK APP 4105/4885HSD17B10 3965/4885TSHR 1277/4885

“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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