SCHEMBL16740212

SCHEMBL16740212

N#Cc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(CO)nc3ccc(F)cn23)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 1/20 0.36
▸ CSNK1G2 P78368 1/20 0.36
▸ TRPA1 O75762 2/20 0.35
▸ CYP11B2 P19099 2/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ GALR2 O43603 1/20 0.33
▸ MCHR1 Q99705 2/20 0.32
▸ TRPV1 Q8NER1 2/20 0.32
▸ BMI1 P35226 1/20 0.32
▸ CTSS P25774 1/20 0.32
▸ CTSK P43235 1/20 0.32
▸ ALOX5 P09917 2/20 0.31
▸ EPHX2 P34913 2/20 0.31
▸ GPR139 Q6DWJ6 1/20 0.31
▸ AGPAT2 O15120 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.30
▸ ABL1 P00519 1/20 0.30
▸ BCR P11274 1/20 0.30
▸ DHODH Q02127 1/20 0.30

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
SCHEMBL16747905 0.89 TRPA1 (0.33) TRPA1CYP11B2CYP11B1MCHR1ABCG2
SCHEMBL16747943 0.89 TNF (0.36) TRPA1CYP11B2CYP11B1TRPV1ABL1
SCHEMBL16740159 0.87 TRPA1 (0.39) CSNK1DCSNK1G2TRPA1CYP11B2CYP11B1
SCHEMBL16747920 0.86 PKM (0.41) CSNK1DCSNK1G2GALR2TRPV1ABCG2
SCHEMBL16747966 0.86 CSNK1D (0.40) CSNK1DCSNK1G2TRPA1CYP11B2CYP11B1
SCHEMBL16747910 0.85 GALR2 (0.35) TRPA1CYP11B2GALR2BMI1
SCHEMBL16740260 0.85 TNF (0.34) TRPA1CYP11B2CYP11B1
SCHEMBL16740096 0.84 CSNK1D (0.37) CSNK1DCSNK1G2TRPA1CYP11B2CYP11B1
SCHEMBL16747987 0.83 KCNH2 (0.40) CYP11B2CYP11B1MCHR1BMI1GPR139
SCHEMBL16740111 0.83 CYP11B2 (0.40) CSNK1DCSNK1G2TRPA1CYP11B2CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — US claimed
EP-3071553-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC Therapeutics, Inc. (US) 2016-09-28 — — EP claimed
WO-2015076800-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 — — WO claimed
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2020-03-10 — — US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — US disclosed
WO-2015076800-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 — — 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 (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-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B CSNK1D 3894/4885CSNK1G2 2734/4885TRPA1 4717/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B CSNK1D 3894/4885CSNK1G2 2734/4885TRPA1 4717/4885

“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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