SCHEMBL830188

SCHEMBL830188

CCc1cnc(CC)cn1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.33
NOS2 P35228 2/20 0.33
HRH3 Q9Y5N1 1/20 0.32
CYP1A2 P05177 2/20 0.32
POLB P06746 1/20 0.32
NOS1 P29475 1/20 0.32
CYP2D6 P10635 1/20 0.31
GBA1 P04062 1/20 0.31

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
Dimethylamine SCHEMBL9222538 0.91 NOS3 (0.30) NOS3NOS2
SCHEMBL10280986 0.86
SCHEMBL13455732 0.86 ALDH1A1 (0.32) CYP1A2POLB
SCHEMBL110053 0.86
SCHEMBL293667 0.86 CYP1A2 (0.31) CYP1A2POLB
SCHEMBL17109259 0.86 NPC1 (0.32) POLB
SCHEMBL13771999 0.86 AOC3 (0.35) NOS3NOS2CYP1A2POLBNOS1
SCHEMBL12508384 0.84
SCHEMBL292560 0.84
SCHEMBL1725245 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4659592-A1 FLAVOR ENHANCING COMPOSITION, MANUFACTURING METHOD THEREFOR, AND METHOD FOR ENHANCING FLAVOR OF FOOD PRODUCT House Foods Corporation (JP) 2025-12-10 EP claimed
WO-2024162421-A1 FLAVOR ENHANCING COMPOSITION, MANUFACTURING METHOD THEREFOR, AND METHOD FOR ENHANCING FLAVOR OF FOOD PRODUCT ハウス食品株式会社 2024-08-08 WO claimed
US-11891364-B2 Methods of selectively forming substituted pyrazines R.J. REYNOLDS TOBACCO COMPANY (US) 2024-02-06 US claimed
CN-117486811-A Method for selectively forming substituted pyrazines R.J.雷诺兹烟草公司 2024-02-02 CN claimed
CN-110637012-B Method for selectively forming substituted pyrazines R.J.雷诺兹烟草公司 2023-11-24 CN claimed
US-20210403437-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES REYNOLDS TOBACCO CO R (US) 2021-12-30 US claimed
US-11091446-B2 Methods of selectively forming substituted pyrazines R.J. REYNOLDS TOBACCO COMPANY (US) 2021-08-17 US claimed
EP-3601238-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES R. J. Reynolds Tobacco Company (US) 2020-02-05 EP claimed
CN-110637012-A Process for selectively forming substituted pyrazines R.J.雷诺兹烟草公司 2019-12-31 CN claimed
US-20180273492-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES R.J. REYNOLDS TOBACCO COMPANY 2018-09-27 US claimed
WO-2018172995-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES R. J. REYNOLDS TOBACCO COMPANY (US) 2018-09-27 WO claimed
EP-2164335-B1 BAKED COMPOSITION NESTEC SA (CH) 2018-03-07 EP claimed
US-8840946-B2 Baked composition NESTEC S.A. (CH) 2014-09-23 US claimed
US-20100233330-A1 BAKED COMPOSITION NESTEC S.A. (CH) 2010-09-16 US claimed
EP-2164335-A2 BAKED COMPOSITION NESTEC S.A. (CH) 2010-03-24 EP claimed
WO-2008148737-A2 BAKED COMPOSITION NESTEC S.A. (CH) 2008-12-11 WO claimed
EP-2000032-A1 Baked composition Nestec S.A. (CH) 2008-12-10 EP claimed
JP-11313635-A None JP disclosed
US-3931166-A FLAVORANTS FIRMENICH & CIE (CH) 1976-01-06 US disclosed
US-3931245-A FURYLALKYLTHIOL CARBOXYLATES FIRMENICH & CIE (CH) 1976-01-06 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 (4 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-20180273492-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES KHK, HK2, HK1 NOS3 2076/4885NOS2 1932/4885HRH3 489/4885
US-11891364-B2 Methods of selectively forming substituted pyrazines KHK, HK2, HK1 NOS3 2076/4885NOS2 1932/4885HRH3 489/4885
US-11091446-B2 Methods of selectively forming substituted pyrazines KHK, HK2, HK1 NOS3 2076/4885NOS2 1932/4885HRH3 489/4885
US-20210403437-A1 METHODS OF SELECTIVELY FORMING SUBSTITUTED PYRAZINES KHK, HK2, HK1 NOS3 2076/4885NOS2 1932/4885HRH3 489/4885

“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.