SCHEMBL3992249

SCHEMBL3992249

c1ccc(Cc2cnc3ccccc3n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.64
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
HTT P42858 3/20 0.49
LMNA P02545 1/20 0.49
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PDGFRB P09619 1/20 0.43
PDGFRA P16234 1/20 0.43
CALM1 P0DP23 1/20 0.42

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
SCHEMBL27927000 0.93 PDE10A (0.56) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL28237594 0.82 PDE10A (0.81) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL27425206 0.81 NPC1 (0.56) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL22762116 0.79 ALDH1A1 (0.45) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL12066225 0.79 PDE10A (1.00) PDE10AMAPTMEN1KMT2A
SCHEMBL27072915 0.78 CALM1 (0.55) ALDH1A1LMNARAB9ACALM1
SCHEMBL19287901 0.78 PDE10A (0.67) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL27926999 0.75 PDE10A (0.68) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL17179177 0.75 PDE10A (0.69) PDE10AMAPTMEN1KMT2AALDH1A1
SCHEMBL27686 0.75 PDE10A (0.69) PDE10AMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117619591-A Pressure-resistant high-molecular perfume spray head with double button ribs on head cap and preparation method thereof 浙江正庄实业有限公司 2024-03-01 CN claimed
CN-117599981-A High-toughness polymer perfume spray head with inverted valve needle and preparation method thereof 浙江正庄实业有限公司 2024-02-27 CN claimed
CN-112820893-A Bipolar plate for electric pile, application and fuel electric pile 坤艾新材料科技(上海)有限公司 2021-05-18 CN claimed
CN-222093692-U Pressure-resistant high-polymer perfume spray head with double button ribs on head cap 浙江正庄实业有限公司 2024-12-03 CN disclosed
CN-221433520-U High-toughness polymer perfume spray head with inverted valve needle 浙江正庄实业有限公司 2024-07-30 CN disclosed
CN-117619591-A Pressure-resistant high-molecular perfume spray head with double button ribs on head cap and preparation method thereof 浙江正庄实业有限公司 2024-03-01 CN disclosed
CN-117599981-A High-toughness polymer perfume spray head with inverted valve needle and preparation method thereof 浙江正庄实业有限公司 2024-02-27 CN disclosed
CN-112820893-A Bipolar plate for electric pile, application and fuel electric pile 坤艾新材料科技(上海)有限公司 2021-05-18 CN disclosed
CN-110483421-A A kind of preparation method of quinokysalines derivative UNIV SHENYANG NORMAL 2019-11-22 CN disclosed
CN-108587068-B A kind of hydrophobic fire retarding epoxide resin and preparation method thereof 福州大学 2019-10-15 CN disclosed
CN-108587068-A A kind of hydrophobic fire retarding epoxide resin and preparation method thereof 福州大学 2018-09-28 CN disclosed
US-9328079-B2 Process for producing optically active amine TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-05-03 US disclosed
US-9328079-B2 Process for producing optically active amine TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-05-03 US disclosed
US-20150210657-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINE TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-07-30 US disclosed
US-20150210657-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINE TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-07-30 US disclosed
US-20150210657-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINE TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-07-30 US disclosed
WO-2014038666-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINE 高砂香料工業株式会社 (JP) 2014-03-13 WO disclosed
US-7501416-B2 Quinoxaline compounds and methods of using them BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-10 US disclosed
WO-2005077920-A1 QUINOXALINE COMPOUNDS AND METHODS OF USING THEM BRISTOL-MYERS SQUIBB COMPANY (US) 2005-08-25 WO disclosed
US-20050176717-A1 Quinoxaline compounds and methods of using them BRISTOL-MYERS SQUIBB COMPANY 2005-08-11 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 (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-20050176717-A1 Quinoxaline compounds and methods of using them NQO1, NQO2, SDHA PDE10A 1943/4885MAPT 3545/4885MEN1 1031/4885
US-20150210657-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE AMINE HRH3, HRH1, ATIC PDE10A 337/4885MAPT 3781/4885MEN1 1200/4885

“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.