SCHEMBL1615795

SCHEMBL1615795

[CH2]OC(=O)c1ccncc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.59
NAPRT Q6XQN6 1/20 0.52
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
LMNA P02545 2/20 0.50
CYP2C9 P11712 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
KDM4E B2RXH2 4/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
MPO P05164 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL647632 0.80 HSD17B10 (0.64) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL21397880 0.78 HSD17B10 (0.61) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL28358911 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL27791013 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL27511341 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL1480310 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA
Methyl Isonicotinate SCHEMBL180574 0.76 CYP1A2 (0.60) HSD17B10NAPRTCYP1A2CYP2C19LMNA
Methyl Isonicotinate SCHEMBL820082 0.76 CYP1A2 (0.60) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL15972749 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA
SCHEMBL27418916 0.76 HSD17B10 (0.59) HSD17B10NAPRTCYP1A2CYP2C19LMNA

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130005730-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS MEDIVIR AB (SE) 2013-01-03 US claimed
EP-2499120-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS Novadex Pharmaceuticals AB (SE) 2012-09-19 EP claimed
WO-2011056126-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS NOVADEX PHARMACEUTICALS AB (SE) 2011-05-12 WO claimed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP claimed
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed
US-20130005730-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS MEDIVIR AB (SE) 2013-01-03 US disclosed
US-20110190296-A1 Substituted Pyrrole Derivatives and Their Use as HMG-CO Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2011-08-04 US disclosed
US-20110190369-A1 Substituted Pyrrole Derivatives and Their Use as HMG-CO Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2011-08-04 US disclosed
WO-2011056126-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS NOVADEX PHARMACEUTICALS AB (SE) 2011-05-12 WO disclosed
EP-2319843-A1 Substituted pyrrole derivatives and their use as HMG-CO inhibitors Ranbaxy Laboratories Limited (IN) 2011-05-11 EP disclosed
US-7923467-B2 Substituted pyrrole derivatives and their use as HMG-CO inhibitors Ranbaxy Laboratories, Inc. (IN) 2011-04-12 US disclosed
US-20100056602-A1 Substituted Pyrrole Derivatives And Their Use As HMG-CO Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2010-03-04 US disclosed
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
WO-2001005770-A1 BENZIMIDAZOLONE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-25 WO disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed
EP-0148883-B1 ALLOPURINOL PRODRUGS A/S GEA Farmaceutisk Fabrik (DK) 1990-02-14 EP disclosed
US-4694006-A Acyl- or acyloxymethyl-allopurinol prodrugs A/S GEA (DK) 1987-09-15 US disclosed
EP-0148883-A1 ALLOPURINOL PRODRUGS. GEA AS (DK) 1985-07-24 EP disclosed
WO-1985000368-A1 ALLOPURINOL PRODRUGS A/S GEA (DK) 1985-01-31 WO disclosed
US-3965099-A Cephalosporin esters with antibacterial activity SMITHKLINE CORPORATION (US) 1976-06-22 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 (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-20130005730-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS REN, AGTR1, ACE HSD17B10 1199/4885NAPRT 2712/4885CYP1A2 199/4885
US-20100056602-A1 Substituted Pyrrole Derivatives And Their Use As HMG-CO Inhibitors HMGCR, HMGB2, HMGB3 HSD17B10 57/4885NAPRT 1001/4885CYP1A2 546/4885
US-20110190369-A1 Substituted Pyrrole Derivatives and Their Use as HMG-CO Inhibitors HMGCR, HMGB2, HMGB3 HSD17B10 57/4885NAPRT 1001/4885CYP1A2 546/4885
US-20110190296-A1 Substituted Pyrrole Derivatives and Their Use as HMG-CO Inhibitors HMGCR, HMGB2, HMGB3 HSD17B10 57/4885NAPRT 1001/4885CYP1A2 546/4885

“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.