Pyrimidine

Pyrimidine

SCHEMBL2352439

Cc1ccc(S(=O)(=O)O)cc1.c1cncnc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Pyrimidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR known ✓ P00533 1/20 0.45
▸ MAPT P10636 3/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ LMNA P02545 3/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ TDP1 Q9NUW8 2/20 0.58
▸ HTT P42858 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ NAPRT Q6XQN6 1/20 0.50
▸ CYP2D6 P10635 3/20 0.45
▸ PTGS2 P35354 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ TSHR P16473 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ HPGD P15428 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
Pyridine SCHEMBL20958 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL31483849 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL2126952 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL7656088 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL3261023 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL6427981 0.89 ALDH1A1 (0.58) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL28538739 0.87 ALDH1A1 (0.57) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL28299965 0.87 ALDH1A1 (0.57) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL5968326 0.87 ALDH1A1 (0.57) MAPTALDH1A1LMNASMN1; SMN2KDM4E
Pyridine SCHEMBL28981792 0.87 ALDH1A1 (0.57) MAPTALDH1A1LMNASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024115549-A1 ARYL- AND HETEROARYL-SULFONAMIDE DERIVATIVES AS CCR8 MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-06-06 — — WO disclosed
CN-117836304-A Improved oligonucleotide synthesis 巴克姆股份公司 2024-04-05 — — CN disclosed
CN-113286778-B Ubiquitin analogs MMV疟疾药物投资公司 2023-09-22 — — CN disclosed
CN-113286778-A Panamide analogs MMV疟疾药物投资公司 2021-08-20 — — CN disclosed
CN-105073699-B Compounds containing structural units derived from vinyl ether compounds 东京应化工业株式会社 2019-10-25 — — CN disclosed
EP-2457923-B1 STEROL DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2016-01-27 — — EP disclosed
US-20150119585-A1 STEROL DERIVATIVE KYOWA HAKKO KIRIN CO., LTD (JP) 2015-04-30 — — US disclosed
US-8952003-B2 Sterol derivative KYOWA HAKKO KIRIN CO., LTD (JP) 2015-02-10 — — US disclosed
CN-101778851-B Fused bicyclic pyrimidines BAYER SCHERING PHARMA AG 2013-05-08 — — CN disclosed
CN-102781462-A Novel nucleoside phosphonates and analogs EPIPHANY BIOSCIENCES INC 2012-11-14 — — CN disclosed
CN-1468214-A Novel derivatives of aminocyclohexane - 2004-01-14 — — CN disclosed
US-20030186984-A1 Substituted cyclohexane derivatives HOFFMAN-LA ROCHE INC. 2003-10-02 — — US disclosed
WO-2003053933-A1 HETEROARYL-SUBSTITUTED AMINOCYCLOHEXANE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2003-07-03 — — WO disclosed
EP-1317432-A1 PIPERIDINE DERIVATIVES FOR USE AS 2,3-OXIDOSQUALENE-LANOSTEROL CYCLASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2003-06-11 — — EP disclosed
EP-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 — — EP disclosed
US-20020068753-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. 2002-06-06 — — US disclosed
US-20020045777-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors F.HOFFMANN-LA ROCHE AG (CH) 2002-04-18 — — US disclosed
WO-2002020483-A1 PIPERIDINE DERIVATIVES FOR USE 2,3-OXIDOSQUALENE-LANOSTEROL CYCLASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2002-03-14 — — WO disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 — — WO disclosed
US-5053507-A Liquid crystal dopants ARAKAWA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-10-01 — — 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-20030186984-A1 Substituted cyclohexane derivatives CYP51A1, LSS, CYP46A1 EGFR 4775/4885MAPT 4716/4885ALDH1A1 414/4885
US-20150119585-A1 STEROL DERIVATIVE NR1H3, NR1H2, SREBF1 EGFR 2460/4885MAPT 3023/4885ALDH1A1 1621/4885
US-20020068753-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 EGFR 4467/4885MAPT 4409/4885ALDH1A1 1343/4885
US-20020045777-A1 2,3-oxidosqualene-lanosterol cyclase inhibitors CYP51A1, LSS, CYP46A1 EGFR 4142/4885MAPT 4081/4885ALDH1A1 2260/4885

“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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