SCHEMBL1864672

SCHEMBL1864672

CCCCc1ncncn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
CYP2D6 P10635 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.32
CYP3A4 P08684 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
LMNA P02545 2/20 0.32
TSHR P16473 2/20 0.32
CYP1A2 P05177 2/20 0.32
NFKB1 P19838 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
ALOX15 P16050 1/20 0.32
THPO P40225 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL306173 0.93 TDP1 (0.39) HRH3CYP2D6L3MBTL1CYP3A4TDP1
SCHEMBL11265989 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL28091635 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL20499801 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL2708603 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL28254738 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL27794520 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
SCHEMBL20747030 0.91 KCNH2 (0.42) L3MBTL1CYP3A4TDP1LMNATSHR
Cyanide SCHEMBL27430349 0.89 TDP1 (0.37) HRH3CYP2D6L3MBTL1CYP3A4TDP1
SCHEMBL27872105 0.89 KCNH2 (0.41) L3MBTL1CYP3A4TDP1LMNATSHR

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107866147-B Preparation method of offshore oilfield liquid composite desulfurizer 中海油天津化工研究设计院有限公司 2020-10-30 CN claimed
CN-100497494-C Discoloration prevention in pyrithione-containing coating compositions ARCH CHEM INC (US) 2009-06-10 CN claimed
CN-1624055-A Discoloration prevention in pyrithione-containing coating compositions ARCH CHEM INC (US) 2005-06-08 CN claimed
CN-116194547-A Nitrile solvent 奥升德功能材料运营有限公司 2023-05-30 CN disclosed
CN-112175133-B Acrylic resin and preparation method and application thereof 宁波南大光电材料有限公司 2022-08-19 CN disclosed
US-11267800-B2 Cyclohexyl acid triazole azines as LPA antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2022-03-08 US disclosed
CN-114096377-A Flux, rosin-cored solder using flux, flux-coated solder using flux, and soldering method 千住金属工业株式会社 2022-02-25 CN disclosed
CN-109563025-B Quaternary ammonium compound and suppression of formation of volatile organic compound derived from polyacetal by using same 旭化成株式会社 2021-07-23 CN disclosed
CN-112175133-A Acrylic resin and preparation method and application thereof 宁波南大光电材料有限公司 2021-01-05 CN disclosed
CN-107866147-B Preparation method of offshore oilfield liquid composite desulfurizer 中海油天津化工研究设计院有限公司 2020-10-30 CN disclosed
CN-109205752-A A kind of oil gas field compounding sulfur elimination 重庆领盛化工科技有限公司 2019-01-15 CN disclosed
EP-1642893-B1 s-triazine compounds possessing two substituents selected from bulky para-aminobenzalmalonate and para-aminobenzalmalonamide groups and one aminobenzoate substituent, compositions and uses thereof OREAL (FR) 2011-05-25 EP disclosed
EP-1642893-A1 s-triazine compounds possessing two substituents selected from bulky para-aminobenzalmalonate and para-aminobenzalmalonamide groups and one aminobenzoate substituent, compositions and uses thereof L'OREAL (FR) 2006-04-05 EP disclosed
CN-1624055-A Discoloration prevention in pyrithione-containing coating compositions ARCH CHEM INC (US) 2005-06-08 CN disclosed
CN-1203065-C Non-yellowing para-tertiary-alkyl phenyl substituted triazine and pyrimidine ultraviolet light absorbers CYTEC TECH CORP (US) 2005-05-25 CN disclosed
CN-1306520-A Non-yellowing para-tertiary-alkyl phenyl substituted triazine and pyrimidine ultraviolet light absorbers CYTEC TECH CORP (US) 2001-08-01 CN disclosed
US-5674377-A REDUCING HYDROGEN SULFIDE CONTENT BY ADDING AS SCAVENGER 1,3,5-TRI-TERT-BUTYLHEXAHYDRO-1,3-5-TRIAZINE NALCO/EXXON ENERGY CHEMICALS, L.P. (US) 1997-10-07 US disclosed
CN-86103141-B surfactant composition, preparation method and application thereof 罗纳·布郎克公司化学部 1988-09-14 CN disclosed
CN-86103141-A Novel surfactant composition, its preparation method and application thereof 1986-11-26 CN 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-11267800-B2 Cyclohexyl acid triazole azines as LPA antagonists LPAR3, LPAR1, LPAR2 HRH3 209/4885CYP2D6 3453/4885L3MBTL1 4166/4885

“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.