SCHEMBL6481609

SCHEMBL6481609

CCC(O)(CO)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CHRM3 P20309 1/20 0.46
KCNN4 O15554 2/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
HIF1A Q16665 1/20 0.38
GRM5 P41594 1/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP2D6 P10635 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ALOX15 P16050 1/20 0.37
MEN1 O00255 1/20 0.36
TTR P02766 1/20 0.36

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
SCHEMBL13946505 1.00 CYP2C19 (0.50) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL6481604 1.00 CYP2C19 (0.50) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
Sulfuric Acid SCHEMBL15206344 0.90 CYP2C19 (0.42) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL4307361 0.88 CYP2C19 (0.56) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL7943831 0.85 CYP2C19 (0.58) CYP2C19CYP1A2CYP2C9KCNN4KDM4E
SCHEMBL11331380 0.83 CYP2C19 (0.47) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL28639570 0.83 CYP2C19 (0.47) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL23014014 0.80 CYP2C19 (0.48) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL1292634 0.80 TAAR1 (0.50) CYP2C19CYP1A2CYP2C9CHRM3KCNN4
SCHEMBL29703352 0.79 ESR2 (0.44) CYP2C19CYP1A2CYP2C9CHRM3SMN1; 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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108704492-A A kind of preparation method of porous silicon carbide ceramic membrane 台州利欧环保新材料有限公司 2018-10-26 CN claimed
CN-108658604-A A kind of preparation method of porous silicon carbide flat ceramic supporter 台州利欧环保新材料有限公司 2018-10-16 CN claimed
CN-107267667-A DNA/RNA virus PCR real time enhancings reaction kit, detection reagent and its application method 成都海之元生物科技有限公司 2017-10-20 CN claimed
CN-101062861-A Photon energy ceramic powder and preparation method thereof QUE SHANCAI (CN) 2007-10-31 CN claimed
CN-108704492-A A kind of preparation method of porous silicon carbide ceramic membrane 台州利欧环保新材料有限公司 2018-10-26 CN disclosed
CN-108658604-A A kind of preparation method of porous silicon carbide flat ceramic supporter 台州利欧环保新材料有限公司 2018-10-16 CN disclosed
CN-105591150-A Nonaqueous electrolyte solution, rechargeable battery, micro-hybrid battery, and battery system A123 SYSTEMS LLC 2016-05-18 CN disclosed
CN-105591149-A Rechargeable battery and electrolyte composition thereof A123 SYSTEMS LLC 2016-05-18 CN disclosed
CN-101062861-A Photon energy ceramic powder and preparation method thereof QUE SHANCAI (CN) 2007-10-31 CN disclosed
CN-1329326-C Dielectric material and dielectric material sintered body and wiring board using such ceramic NGK SPARK PLUG CO (JP) 2007-08-01 CN disclosed
WO-2005003140-A1 4-OXO-4,7-DIHYDROTHIENO[2,3-B]PYRIDINE-5-CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-01-13 WO disclosed
US-20050004161-A1 4-oxo-4,7-dihydrothieno[2,3-b]pyridine-5-carboxamides as antiviral agents AGOURON PHARMACEUTICALS, INC. 2005-01-06 US disclosed
US-4204010-A Radiation curable, ethylenically unsaturated thixotropic agent and method of preparation W. R. GRACE & CO. (US) 1980-05-20 US disclosed
US-4137389-A Low-molecular weight acrylate resins and a process for their production BAYER AKTIENGESELLSCHAFT (DE) 1979-01-30 US disclosed
US-4031290-A ALPHA-BETA MONOMERS, CATALYSIS PPG INDUSTRIES, INC. (US) 1977-06-21 US disclosed
US-4025474-A AUTOMOTIVE FINISHING PPG INDUSTRIES, INC. (US) 1977-05-24 US disclosed
US-4016332-A OF ETHYLENICALLY UNSATURATED MONOMERS PPG INDUSTRIES, INC. (US) 1977-04-05 US disclosed
US-3994851-A AMINE-ALDEHYDE CROSSLINKING AGENT PPG INDUSTRIES, INC. (US) 1976-11-30 US disclosed
US-3954440-A Substituted 2-hydroxy-2-phenylbutylsulfonate compounds THE DOW CHEMICAL COMPANY (US) 1976-05-04 US disclosed
US-3933940-A Mercaptan blocked thermosetting copolymers PPG INDUSTRIES, INC. (US) 1976-01-20 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 (1 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-20050004161-A1 4-oxo-4,7-dihydrothieno[2,3-b]pyridine-5-carboxamides as antiviral agents ZC3HAV1, IRF3, BRD4 CYP2C19 2078/4885CYP1A2 1382/4885CYP2C9 1819/4885

“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.