SCHEMBL3417387

SCHEMBL3417387

Cc1ccc(C)c2cocc12

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
CYP2A6 P11509 3/20 0.40
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
ACHE P22303 1/20 0.32
NQO1 P15559 1/20 0.30
POR P16435 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 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
SCHEMBL28328895 0.84 OPRK1 (0.41) CYP1A2ESR1ESR2TSHRALDH1A1
SCHEMBL8404429 0.73 TSHR (0.48) CYP1A2CYP2A6TSHRALDH1A1TDP1
SCHEMBL3871139 0.73 CYP2A6 (0.52) CYP1A2CYP2A6TSHRALDH1A1TDP1
SCHEMBL426079 0.70
SCHEMBL14299138 0.68 CCR1 (0.33) CCR1CCR5CCR8
SCHEMBL31001023 0.67 CYP1A2 (0.56) CYP1A2CYP2A6TSHRALDH1A1TDP1
SCHEMBL5156814 0.65
SCHEMBL31073495 0.65 MEN1 (0.32) KMT2A
SCHEMBL601246 0.65 CYP1A2 (0.53) CYP1A2CYP2A6TSHRALDH1A1TDP1
SCHEMBL161370 0.65 CYP1A2 (1.00) CYP1A2CYP2A6TSHRALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114920911-B Method for producing polyisothiaindene conductive polymer 株式会社力森诺科 2024-05-03 CN disclosed
CN-114920911-A Method for producing polyisothianaphthene-based conductive polymer 昭和电工株式会社 2022-08-19 CN disclosed
CN-110121516-B Method for producing polyisothianaphthene-based conductive polymer 昭和电工株式会社 2022-07-01 CN disclosed
US-11183340-B2 Method for manufacturing solid electrolytic capacitor SHOWA DENKO K.K. (JP) 2021-11-23 US disclosed
US-11136432-B2 Method for producing polyisothianaphthene-based electroconductive polymer SHOWA DENKO K.K. (JP) 2021-10-05 US disclosed
CN-110121757-B Method for manufacturing solid electrolytic capacitor 昭和电工株式会社 2021-09-14 CN disclosed
US-20200090874-A1 METHOD FOR MANUFACTURING SOLID ELECTROLYTIC CAPACITOR SHOWA DENKO K.K. (JP) 2020-03-19 US disclosed
US-20190345287-A1 METHOD FOR PRODUCING POLYISOTHIANAPHTHENE-BASED ELECTROCONDUCTIVE POLYMER SHOWA DENKO K.K. (JP) 2019-11-14 US disclosed
EP-3564290-A1 METHOD FOR PRODUCING POLYISOTHIANAPHTHENE ELECTROCONDUCTIVE POLYMER Showa Denko K.K. (JP) 2019-11-06 EP disclosed
EP-3564976-A1 METHOD FOR MANUFACTURING SOLID ELECTROLYTIC CAPACITOR Showa Denko K.K. (JP) 2019-11-06 EP disclosed
US-20100266556-A1 METHOD FOR EXPANDING HEMATOPOIETIC STEM CELLS USING HETEROCYCLIC COMPOUND NISSAN CHEMICAL INDUSTRIES LTD. (JP) 2010-10-21 US disclosed
US-20100127220-A1 Process for Preparing Substituted Pentacenes MERCK PATENT GMBH (DE) 2010-05-27 US disclosed
US-20100127220-A1 Process for Preparing Substituted Pentacenes MERCK PATENT GMBH (DE) 2010-05-27 US disclosed
US-20100127220-A1 Process for Preparing Substituted Pentacenes MERCK PATENT GMBH (DE) 2010-05-27 US disclosed
CN-101663309-A Process for preparing substituted pentacenes MERCK PATENT GMBH 2010-03-03 CN disclosed
EP-2134725-A1 PROCESS FOR PREPARING SUBSTITUTED PENTACENES Merck Patent GmbH (DE) 2009-12-23 EP disclosed
WO-2008128618-A1 PROCESS FOR PREPARING SUBSTITUTED PENTACENES MERCK PATENT GMBH (DE) 2008-10-30 WO disclosed
WO-2008128618-A1 PROCESS FOR PREPARING SUBSTITUTED PENTACENES MERCK PATENT GMBH (DE) 2008-10-30 WO disclosed
WO-2007043675-A9 COMPOSITION FOR CONDUCTIVE MATERIALS, CONDUCTIVE MATERIAL, CONDUCTIVE LAYER, ELECTRONIC DEVICE, AND ELECTRONIC EQUIPMENT SEIKO EPSON CORP (JP) 2007-06-07 WO disclosed
WO-2007010880-A1 LIGHT EMITTING DEVICE AND ELECTRONIC EQUIPMENT PROVIDED WITH THE LIGHT EMITTING DEVICE SEIKO EPSON CORPORATION (JP) 2007-01-25 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-20100266556-A1 METHOD FOR EXPANDING HEMATOPOIETIC STEM CELLS USING HETEROCYCLIC COMPOUND HCLS1, RUNX1, ACIN1 CYP1A2 2808/4885CYP2A6 2755/4885ESR1 3366/4885
US-20100127220-A1 Process for Preparing Substituted Pentacenes FES, PFAS, SLC46A1 CYP1A2 1513/4885CYP2A6 3116/4885ESR1 1026/4885

“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.