SCHEMBL486925

SCHEMBL486925

CC(C)=Nc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 7/20 0.67
NOS3 P29474 5/20 0.67
HTR3E A5X5Y0 2/20 0.55
HTR3B O95264 2/20 0.55
HTR3A P46098 2/20 0.55
HTR3D Q70Z44 2/20 0.55
HTR3C Q8WXA8 2/20 0.55
SLC22A2 O15244 1/20 0.55
SLC22A1 O15245 1/20 0.55
SLC22A3 O75751 1/20 0.55
PLAU P00749 1/20 0.55
MAPT P10636 2/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
LMNA P02545 2/20 0.46
NFKB1 P19838 2/20 0.46
CYP1A2 P05177 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP2C19 P33261 1/20 0.46
BLM P54132 1/20 0.46

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
SCHEMBL165971 0.82 NOS1 (0.67) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL2348627 0.82 NOS1 (0.67) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL165970 0.82 NOS1 (0.67) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL714543 0.80 NOS1 (0.68) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL3785375 0.80 NOS1 (1.00) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL7448212 0.80 NOS1 (1.00) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL6650679 0.80 NOS1 (0.64) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL6273560 0.80 NOS1 (1.00) NOS1NOS3HTR3EHTR3BHTR3A
SCHEMBL26208553 0.79 APP (0.50) NOS1NOS3MAPTCYP1A2NOS2
SCHEMBL5078486 0.79 ALDH1A1 (0.55) NOS1NOS3MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2880013-B1 METHOD FOR PRODUCING SUBSTITUTED BIPHENYLS USING C-H ACTIVATION BAYER CROPSCIENCE AG (DE) 2018-05-09 EP claimed
US-9199915-B2 Process for preparing substituted biphenyls by C-H activation BAYER CROPSCIENCE AG (DE) 2015-12-01 US claimed
CN-103937435-B For the synthesis of the preparation method of the solvent-free waterborne polyurethane resin of leather adhesive linkage ZHEJIANG NAIHE INDUSTRIAL CO., LTD. (CN) 2015-11-11 CN claimed
US-20150203440-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLS BY C-H ACTIVATION BAYER CROPSCIENCE AG (DE) 2015-07-23 US claimed
EP-2880013-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLS BY C-H ACTIVATION Bayer CropScience AG (DE) 2015-06-10 EP claimed
CN-103275522-B Method for preparing silane coupling agent cladding modified talcum powder and silver mirror back coating NANBAO RESIN(CHINA) CO., LTD. (CN) 2014-10-01 CN claimed
CN-103937435-A Method for preparing solvent-free waterborne polyurethane resin for synthesizing leather bonding layer ZHEJIANG NAIHE IND CO LTD 2014-07-23 CN claimed
WO-2014019995-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLS BY C-H ACTIVATION BAYER CROPSCIENCE AG (DE) 2014-02-06 WO claimed
CN-103275522-A Method for preparing silane coupling agent cladding modified talcum powder and silver mirror back coating NAN PAO RESINS CHINA CO LTD 2013-09-04 CN claimed
EP-0715611-A4 1996-06-26 EP claimed
EP-0715611-A1 DEHYDROGENATION USING DEHYDROGENATION CATALYST AND POLYMER-POROUS SOLID COMPOSITE MEMBRANE CHEVRON U.S.A. INC. (US) 1996-06-12 EP claimed
US-5430218-A Dehydrogenation using dehydrogenation catalyst and polymer-porous solid composite membrane CHEVRON U.S.A. INC. (US) 1995-07-04 US claimed
WO-1995006018-A1 DEHYDROGENATION USING DEHYDROGENATION CATALYST AND POLYMER-POROUS SOLID COMPOSITE MEMBRANE CHEVRON U.S.A. INC. (US) 1995-03-02 WO claimed
CN-115353777-B Preparation method of high-permeability conversion rust-free anti-corrosion primer 安徽新大陆特种涂料有限责任公司 2023-10-13 CN disclosed
CN-115353777-A Preparation method of high-permeability conversion rust-free anticorrosive primer 安徽新大陆特种涂料有限责任公司 2022-11-18 CN disclosed
CN-114773265-B Synthesis process of rubber antioxidant RD 科迈化工股份有限公司 2022-09-30 CN disclosed
EP-1026161-A1 Process for producing 1,3-oxazolidine derivatives Daicel Chemical Industries, Ltd. (JP) 2000-08-09 EP disclosed
EP-0715611-A4 1996-06-26 EP disclosed
EP-0715611-A1 DEHYDROGENATION USING DEHYDROGENATION CATALYST AND POLYMER-POROUS SOLID COMPOSITE MEMBRANE CHEVRON U.S.A. INC. (US) 1996-06-12 EP disclosed
WO-1995006018-A1 DEHYDROGENATION USING DEHYDROGENATION CATALYST AND POLYMER-POROUS SOLID COMPOSITE MEMBRANE CHEVRON U.S.A. INC. (US) 1995-03-02 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 (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-20150203440-A1 PROCESS FOR PREPARING SUBSTITUTED BIPHENYLS BY C-H ACTIVATION CYP1A1, CBR1, AHR NOS1 459/4885NOS3 529/4885HTR3E 1468/4885

“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.