SCHEMBL16747837

SCHEMBL16747837

Cc1nc2ccc(F)cn2c1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.42
▸ SCN5A Q14524 2/20 0.42
▸ SCN9A Q15858 2/20 0.42
▸ BMI1 P35226 5/20 0.39
▸ CYP11B1 P15538 4/20 0.37
▸ CYP11B2 P19099 4/20 0.37
▸ DHODH Q02127 1/20 0.36
▸ BRAF P15056 2/20 0.35
▸ MCHR1 Q99705 1/20 0.34
▸ AGPAT2 O15120 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ ABL1 P00519 1/20 0.34
▸ BCR P11274 1/20 0.34

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
SCHEMBL16739829 0.91 BRAF (0.42) KCNH2SCN5ASCN9ACYP11B1CYP11B2
SCHEMBL16739987 0.89 KCNH2 (0.41) KCNH2SCN5ASCN9ABMI1DHODH
SCHEMBL16740229 0.88 KCNH2 (0.42) KCNH2SCN5ASCN9ABMI1CYP11B1
SCHEMBL16747845 0.88 THRB (0.43) CYP11B1CYP11B2
SCHEMBL16739953 0.87 CDK2 (0.43) KCNH2SCN5ASCN9ACYP11B1CYP11B2
SCHEMBL16740170 0.87 CDK2 (0.42) CYP11B1CYP11B2BRAF
SCHEMBL16747839 0.87 KCNH2 (0.47) KCNH2SCN5ASCN9ACYP11B1CYP11B2
SCHEMBL16739790 0.87 KCNH2 (0.47) KCNH2SCN5ASCN9ABMI1DHODH
SCHEMBL16740204 0.86 CYP11B2 (0.39) CYP11B1CYP11B2DHODHBRAF
SCHEMBL16739904 0.86 KCNH2 (0.40) KCNH2SCN5ASCN9ABMI1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2020-03-10 — — US claimed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 — — US 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 KCNH2 3952/4885SCN5A 3115/4885SCN9A 4295/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B KCNH2 3952/4885SCN5A 3115/4885SCN9A 4295/4885

“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.

Send feedback