SCHEMBL3607306

SCHEMBL3607306

Fc1ccc[c]c1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
SLC22A2 O15244 1/20 0.34
SLC22A1 O15245 1/20 0.34
SLC22A3 O75751 1/20 0.34
SLC6A4 P31645 1/20 0.34
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
PKM P14618 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
KMT2A Q03164 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NFE2L2 Q16236 3/20 0.31
AR P10275 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
SCHEMBL150096 0.84 MAOB (0.32) ACHENPC1RAB9ANFE2L2AR
SCHEMBL1491042 0.81 ALDH1A1 (0.38) ALDH1A1MEN1NPC1MAPK1RAB9A
SCHEMBL435279 0.81 CYP1A2 (0.38) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL11288386 0.81 LMNA (0.39) NPC1PKMMAPK1RAB9AKMT2A
SCHEMBL12815215 0.80 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10494072 0.79 TAAR1 (0.41) ACHEMEN1KMT2A
SCHEMBL15757626 0.78 LMNA (0.34) ALDH1A1
SCHEMBL434023 0.77 NOTUM (0.35) ALDH1A1ACHEMEN1NPC1PKM
SCHEMBL6189267 0.77 CYP1A2 (0.33) ALDH1A1
SCHEMBL4275387 0.77 HSD17B1 (0.47) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153682-B Novel pyrazine compounds with oxygen, sulfur and nitrogen linkers for the treatment of infectious diseases 豪夫迈·罗氏有限公司 2021-05-25 CN claimed
US-5698169-A USING DICARBOLLIDE OR DICARBAEXTRANIDE COMPLEX; ION EXCHANGING COREMETALS RESEARCH, INC. (US) 1997-12-16 US claimed
US-5666642-A DICARBOLIDES COREMETALS RESEARCH, INC. (US) 1997-09-09 US claimed
WO-1996039702-A2 METHODS AND AGENTS FOR THE EXTRACTION OF CESIUM AND STRONTIUM FROM NUCLEAR WASTE COREMETALS RESEARCH, INC. (US) 1996-12-12 WO claimed
WO-1996033132-A1 EXTRACTION OF CESIUM AND STRONTIUM IONS FROM NUCLEAR WASTE COREMETALS RESEARCH, INC. (US) 1996-10-24 WO claimed
US-11969002-B2 Savoury and mouthfulness taste enhancers LUCTA, S.A. (ES) 2024-04-30 US disclosed
EP-3864012-B1 SAVOURY AND MOUTHFULNESS TASTE ENHANCERS LUCTA S A (ES) 2023-09-13 EP disclosed
CN-107793409-B Dihydropyrimidine compound and application thereof in medicine 广东东阳光药业有限公司 2022-09-27 CN disclosed
CN-110088103-B Novel tetrahydropyridopyrimidine compounds for the treatment and prophylaxis of hepatitis b virus infection 豪夫迈·罗氏有限公司 2022-04-12 CN disclosed
US-20210337850-A1 SAVOURY AND MOUTHFULNESS TASTE ENHANCERS LUCTA, S.A. (ES) 2021-11-04 US disclosed
EP-3864012-A1 SAVOURY AND MOUTHFULNESS TASTE ENHANCERS Lucta, S.A. (ES) 2021-08-18 EP disclosed
CN-109153682-B Novel pyrazine compounds with oxygen, sulfur and nitrogen linkers for the treatment of infectious diseases 豪夫迈·罗氏有限公司 2021-05-25 CN disclosed
WO-2001047875-A1 SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-07-05 WO disclosed
WO-2000056800-A1 TWO-COMPONENT PREPARATIONS CONTAINING EPOXY COMPOUNDS 3M ESPE AG (DE) 2000-09-28 WO disclosed
EP-1028945-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS Amgen Inc. (US) 2000-08-23 EP disclosed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO disclosed
US-4551464-A AND SULFIMINO CARBOSTYRILS DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1985-11-05 US disclosed
EP-0071150-B1 SULFIMINES, THEIR SALTS AND THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1985-07-03 EP disclosed
US-4442111-A Antithrombotic sulfimino and sulfoximino indolinones-2 DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-04-10 US disclosed
EP-0071150-A1 Sulfimines, their salts and their preparation, and pharmaceutical compositions containing them Dr. Karl Thomae GmbH (DE) 1983-02-09 EP 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-20210337850-A1 SAVOURY AND MOUTHFULNESS TASTE ENHANCERS KCNJ6, TAS1R1, TAS2R5 ALDH1A1 1833/4885SLC22A2 2920/4885SLC22A1 3012/4885
US-11969002-B2 Savoury and mouthfulness taste enhancers TAS1R1, KCNJ6, KCNJ5 ALDH1A1 1527/4885SLC22A2 3044/4885SLC22A1 3033/4885

“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.