SCHEMBL10131073

SCHEMBL10131073

Nc1cc(Cl)c(/N=N/c2ccccc2)c(N)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.51
▸ TDP1 Q9NUW8 7/20 0.51
▸ MEN1 O00255 7/20 0.51
▸ MAPK1 P28482 5/20 0.51
▸ LMNA P02545 3/20 0.51
▸ CYP1A2 P05177 3/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ HBB P68871 2/20 0.51
▸ HIF1A Q16665 2/20 0.51
▸ CYP2C9 P11712 2/20 0.51
▸ CYP2C19 P33261 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ CHRM1 P11229 1/20 0.51
▸ DRD2 P14416 1/20 0.51
▸ ADRA2B P18089 1/20 0.51
▸ ADRA2C P18825 1/20 0.51
▸ CHRM3 P20309 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ TBXA2R P21731 1/20 0.51
▸ PTGS1 P23219 1/20 0.51

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
SCHEMBL9487216 1.00 KMT2A (0.51) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL17595329 0.87 MAPT (0.54) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL17595330 0.87 MAPT (0.54) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL5306846 0.80 KMT2A (0.51) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL18621539 0.80 TDP1 (0.51) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL5306843 0.80 KMT2A (0.51) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL10708407 0.74 MAPT (0.64) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL10708396 0.74 MAPT (0.64) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL20672109 0.73 MAPT (0.44) KMT2ATDP1MEN1MAPK1LMNA
SCHEMBL28548824 0.72 ALDH1A1 (0.52) KMT2ATDP1MEN1MAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981879-B2 Thioether triazolopyridine and triazolopyrimidine inhibitors of myeloperoxidase BRISTOL-MYERS SQUIBB COMPANY (US) 2021-04-20 — — US disclosed
US-20190031623-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2019-01-31 — — US disclosed
EP-3191486-B1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL MYERS SQUIBB CO (US) 2018-08-01 — — EP disclosed
US-20170247343-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-31 — — US disclosed
US-20170247343-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-31 — — US disclosed
US-20120046232-A1 COMPOSITIONS AND METHODS FOR REDUCING RELAPSE OF ADDICTIVE BEHAVIOR MEDICAL UNIVERSITY OF SOUTH CAROLINA 2012-02-23 — — US disclosed
US-20120046232-A1 COMPOSITIONS AND METHODS FOR REDUCING RELAPSE OF ADDICTIVE BEHAVIOR MEDICAL UNIVERSITY OF SOUTH CAROLINA 2012-02-23 — — US disclosed
US-20110046092-A1 SMALL MOLECULES FOR NEURONAL DIFFERENTIATION OF EMBRYONIC STEM CELLS RESEARCH DEVELOPMENT FOUNDATION (US) 2011-02-24 — — US disclosed
US-20110046092-A1 SMALL MOLECULES FOR NEURONAL DIFFERENTIATION OF EMBRYONIC STEM CELLS RESEARCH DEVELOPMENT FOUNDATION (US) 2011-02-24 — — 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 (5 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-20120046232-A1 COMPOSITIONS AND METHODS FOR REDUCING RELAPSE OF ADDICTIVE BEHAVIOR GRM6, GRM5, GRM7 KMT2A 2213/4885TDP1 3148/4885MEN1 3871/4885
US-20190031623-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE EPX, MPO, SERPINB1 KMT2A 1894/4885TDP1 660/4885MEN1 4776/4885
US-20170247343-A1 THIOETHER TRIAZOLOPYRIDINE AND TRIAZOLOPYRIMIDINE INHIBITORS OF MYELOPEROXIDASE EPX, MPO, SERPINB1 KMT2A 1894/4885TDP1 660/4885MEN1 4776/4885
US-20110046092-A1 SMALL MOLECULES FOR NEURONAL DIFFERENTIATION OF EMBRYONIC STEM CELLS NES, DCX, GAP43 KMT2A 378/4885TDP1 2719/4885MEN1 4738/4885
US-10981879-B2 Thioether triazolopyridine and triazolopyrimidine inhibitors of myeloperoxidase EPX, MPO, SERPINB1 KMT2A 1894/4885TDP1 660/4885MEN1 4776/4885

“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.

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