SCHEMBL317332

SCHEMBL317332

c1ccc(CC2COCCS2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.38
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.36
GBA1 P04062 1/20 0.35
DPP4 P27487 1/20 0.35
MAOB P27338 1/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
ACE P12821 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CCR3 P51677 1/20 0.34
CTRB1 P17538 1/20 0.34

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
SCHEMBL6916462 0.73 GBA1 (0.43) POLBGBA1ACECCR3
SCHEMBL8998 0.73 FAAH (0.43) POLBGBA1ACECCR3
SCHEMBL28090 0.72 POLB (0.44) POLBGBA1CCR3
SCHEMBL9150 0.72 TMEM97 (0.44) NPC1POLBRAB9ASMN1; SMN2GBA1
SCHEMBL27689141 0.69 GBA1 (0.50) SMN1; SMN2TSHRGBA1CCR3
SCHEMBL5269898 0.69 GBA1 (0.50) SMN1; SMN2TSHRGBA1CCR3
SCHEMBL694287 0.69 MAOB (0.48) POLBGBA1MAOBSLC6A2SLC6A4
SCHEMBL9185438 0.69 GBA1 (0.34) TAAR1GBA1ACE
SCHEMBL8485 0.68 SLC6A2 (0.42) TAAR1NPC1RAB9AMAPTSLC6A2
SCHEMBL450052 0.67 GBA1 (0.42) POLBGBA1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093241-B2 Acid amide derivatives, process for their production and pesticides containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 2012-01-10 US claimed
US-20100093707-A1 ACID AMIDE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2010-04-15 US claimed
US-20040254237-A1 Acid amide derivatives, process for producing these, and pest agent containing these ISHIHARA SANGYO KAISHA LTD. (JP) 2004-12-16 US claimed
EP-1428817-A1 ACID AMIDE DERIVATIVES, PROCESS FOR PRODUCING THESE, AND PEST CONTROL AGENT CONTAINING THESE ISHIHARA SANGYO KAISHA, LTD. (JP) 2004-06-16 EP claimed
US-6036888-A ADDING SULFUR-CONTAINING HETEROCYCLIC RING COMPOUNDS TO AQUEOUS ALKANOLAMINE SOLUTION TO INHIBIT CORROSION OF METALS IN ACID GAS RICH AND ACID GAS LEAN PORTIONS OF AN ACID GAS REMOVAL UNIT BETZDEARBORN INC. (US) 2000-03-14 US claimed
WO-1999010561-A1 CORROSION INHIBITOR FOR ALKANOLAMINE UNITS BETZDEARBORN INC. (US) 1999-03-04 WO claimed
EP-4361166-A1 FLUORESCENT PROBES Tohoku Techno Arch Co., Ltd. (JP) 2024-05-01 EP disclosed
WO-2023249007-A1 CALPAIN INHIBITOR 五稜化薬株式会社 2023-12-28 WO disclosed
CN-111867579-B Methods of treating generalized pustular psoriasis with CCR6 or CXCR2 antagonists 凯莫森特里克斯股份有限公司 2023-11-24 CN disclosed
CN-116710138-A Peptide crosslinking agent and crosslinked peptide crosslinked by the same 国立大学法人鹿儿岛大学 2023-09-05 CN disclosed
WO-2023149548-A1 NOVEL PHARMACEUTICAL COMPOSITION 国立大学法人富山大学 2023-08-10 WO disclosed
WO-2023149549-A1 NOVEL PHARMACEUTICAL COMPOSITION 国立大学法人富山大学 2023-08-10 WO disclosed
WO-2022270607-A1 FLUORESCENT PROBES 株式会社 東北テクノアーチ 2022-12-29 WO disclosed
WO-2008099902-A1 PYRIDYL-TRIAZOLOPYRIMIDINE DERIVATIVE OR ITS SALT, PESTICIDE CONTAINING IT AND ITS PRODUCTION PROCESS ISHIHARA SANGYO KAISHA, LTD. (JP) 2008-08-21 WO disclosed
EP-1776011-A1 FUNGICIDAL COMPOSITION CONTAINING ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA, LTD. (JP) 2007-04-25 EP disclosed
WO-2006016708-A1 FUNGICIDAL COMPOSITION CONTAINING ACID AMIDE DERIVATIVE ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-02-16 WO disclosed
US-20040254237-A1 Acid amide derivatives, process for producing these, and pest agent containing these ISHIHARA SANGYO KAISHA LTD. (JP) 2004-12-16 US disclosed
EP-1428817-A1 ACID AMIDE DERIVATIVES, PROCESS FOR PRODUCING THESE, AND PEST CONTROL AGENT CONTAINING THESE ISHIHARA SANGYO KAISHA, LTD. (JP) 2004-06-16 EP disclosed
US-6036888-A ADDING SULFUR-CONTAINING HETEROCYCLIC RING COMPOUNDS TO AQUEOUS ALKANOLAMINE SOLUTION TO INHIBIT CORROSION OF METALS IN ACID GAS RICH AND ACID GAS LEAN PORTIONS OF AN ACID GAS REMOVAL UNIT BETZDEARBORN INC. (US) 2000-03-14 US disclosed
WO-1999010561-A1 CORROSION INHIBITOR FOR ALKANOLAMINE UNITS BETZDEARBORN INC. (US) 1999-03-04 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 (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-20100093707-A1 ACID AMIDE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND PESTICIDES CONTAINING THEM NAA15, SAP18, CYP2C18 TAAR1 167/4885NPC1 2231/4885POLB 3063/4885
US-20040254237-A1 Acid amide derivatives, process for producing these, and pest agent containing these NAA15, CBR3, CBR1 TAAR1 31/4885NPC1 1548/4885POLB 3499/4885

“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.