SCHEMBL619276

SCHEMBL619276

Cc1nc2ncccc2c(Cl)c1C(=O)NCc1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
PLA2G1B P04054 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
GAA P10253 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
TACR1 P25103 4/20 0.50
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
CCR1 P32246 7/20 0.48
MLYCD O95822 1/20 0.47
DHFR P00374 1/20 0.46

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
SCHEMBL619759 0.87 PSEN1 (0.47) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL251069 0.83 KDM4E (0.49) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL617760 0.82 LMNA (0.56) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL247884 0.81 LMNA (0.52) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL619169 0.76 PPARA (0.51) MEN1KMT2ALMNAHPGDCCR1
SCHEMBL617827 0.76 RIPK1 (0.48) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL617617 0.75 MLYCD (0.48) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL10389082 0.75 MEN1 (0.70) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL619512 0.74 CCR1 (0.57) MEN1KMT2APLA2G1BCYP1A2CYP3A4
SCHEMBL253706 0.74 MLYCD (0.58) MEN1KMT2APLA2G1BCYP1A2CYP3A4

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
EP-2401275-B1 NAPHTHYRIDINE DERIVATIVES HAVING BRONCHODILATING ACTIVITY RESPIRATORIUS AB (SE) 2013-07-24 EP disclosed
EP-2401275-B1 NAPHTHYRIDINE DERIVATIVES HAVING BRONCHODILATING ACTIVITY RESPIRATORIUS AB (SE) 2013-07-24 EP disclosed
US-8415333-B2 Bronchodilating diazaheteroaryls RESPIRATORIOUS AB (SE) 2013-04-09 US disclosed
US-8415333-B2 Bronchodilating diazaheteroaryls RESPIRATORIOUS AB (SE) 2013-04-09 US disclosed
US-8415333-B2 Bronchodilating diazaheteroaryls RESPIRATORIOUS AB (SE) 2013-04-09 US disclosed
US-20120040942-A1 NOVEL BRONCHODILATING DIAZAHETEROARYLS RESPIRATORIUS AB (SE) 2012-02-16 US disclosed
US-20120040942-A1 NOVEL BRONCHODILATING DIAZAHETEROARYLS RESPIRATORIUS AB (SE) 2012-02-16 US disclosed
US-20120040942-A1 NOVEL BRONCHODILATING DIAZAHETEROARYLS RESPIRATORIUS AB (SE) 2012-02-16 US disclosed
WO-2010097410-A1 NOVEL BRONCHODILATING DIAZAHETEROARYLS RESPIRATORIUS AB (SE) 2010-09-02 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 (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-20120040942-A1 NOVEL BRONCHODILATING DIAZAHETEROARYLS CHRM3, ADRB1, ADRB3 MEN1 3494/4885KMT2A 3409/4885PLA2G1B 1133/4885

“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.