SCHEMBL940260

SCHEMBL940260

CCCCCCCCn1cnnn1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
ALDH1A1 P00352 1/20 0.62
KMT2A Q03164 1/20 0.62
TBXAS1 P24557 1/20 0.42
LTB4R Q15722 1/20 0.40
SMPD1 P17405 4/20 0.39
KDR P35968 5/20 0.37
PTGS1 P23219 3/20 0.36
PTGS2 P35354 3/20 0.36
MGLL Q99685 2/20 0.36
FAAH O00519 1/20 0.36
SLC9A1 P19634 2/20 0.36

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
SCHEMBL18672829 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL18649880 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20915328 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20936481 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20936607 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL10950345 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20915528 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20915262 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL20915274 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R
SCHEMBL6050372 1.00 MEN1 (0.62) MEN1ALDH1A1KMT2ATBXAS1LTB4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109135060-A A kind of foamed heat-insulating material and preparation method thereof based on polypropylene matrix 丹阳博亚新材料技术服务有限公司 2019-01-04 CN claimed
CN-109135060-B Foamed heat-insulating material mainly based on polypropylene matrix and preparation method thereof 丹阳博亚新材料技术服务有限公司 2023-03-28 CN disclosed
US-11198691-B2 N-((het)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KALVISTA PHARMACEUTICALS LIMITED (GB) 2021-12-14 US disclosed
US-10966967-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-04-06 US disclosed
US-20200281905-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-09-10 US disclosed
US-20200199116-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors DRI UK LP (KY) 2020-06-25 US disclosed
CN-109135060-A A kind of foamed heat-insulating material and preparation method thereof based on polypropylene matrix 丹阳博亚新材料技术服务有限公司 2019-01-04 CN disclosed
US-9809545-B2 Factor XIa inhibitors MERCK SHARP & DOHME CORP. (US) 2017-11-07 US disclosed
US-20110015403-A1 PROCESS FOR PREPARING IODINATED AZOLES LANXESS DEUTSCHLAND GMBH (DE) 2011-01-20 US disclosed
US-20090306397-A1 Method for the production of substituted azoles LANXESS DEUTSCHLAND GMBH (DE) 2009-12-10 US disclosed
EP-1979333-A1 PROCESS FOR PREPARING IODINATED AZOLES Lanxess Deutschland GmbH (DE) 2008-10-15 EP disclosed
EP-1891025-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED AZOLES Lanxess Deutschland GmbH (DE) 2008-02-27 EP disclosed
WO-2007085349-A1 PROCESS FOR PREPARING IODINATED AZOLES LANXESS DEUTSCHLAND GMBH (DE) 2007-08-02 WO disclosed
WO-2006131228-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED AZOLES LANXESS DEUTSCHLAND GMBH (DE) 2006-12-14 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 (6 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-20200199116-A1 N-((HET)Arylmethyl)-Heteroaryl-Carboxamides Compounds As Kallikrein Inhibitors KLKB1, BDKRB1, BDKRB2 MEN1 826/4885ALDH1A1 3143/4885KMT2A 430/4885
US-20090306397-A1 Method for the production of substituted azoles CYP11B1, CYP11B2, CYP4F11 MEN1 199/4885ALDH1A1 389/4885KMT2A 1480/4885
US-11198691-B2 N-((het)arylmethyl)-heteroaryl-carboxamides compounds as kallikrein inhibitors KLKB1, BDKRB1, BDKRB2 MEN1 826/4885ALDH1A1 3143/4885KMT2A 430/4885
US-10966967-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors DGAT2, MGAT2, MGAT1 MEN1 2323/4885ALDH1A1 284/4885KMT2A 155/4885
US-20200281905-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 MEN1 2323/4885ALDH1A1 284/4885KMT2A 155/4885
US-20110015403-A1 PROCESS FOR PREPARING IODINATED AZOLES AZI2, TPO, INSR MEN1 61/4885ALDH1A1 2523/4885KMT2A 2140/4885

“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.