SCHEMBL16740786

SCHEMBL16740786

CCc1nc2cc(F)ccc2n1-c1nc(N)nc(Nc2ccc(Cl)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 4/20 0.44
AGPAT2 O15120 4/20 0.43
BMI1 P35226 3/20 0.42
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
EGFR P00533 1/20 0.38
CYBB P04839 1/20 0.38
NOX4 Q9NPH5 1/20 0.38
TBXA2R P21731 2/20 0.37
KDM4E B2RXH2 1/20 0.37
BLM P54132 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
SLC6A2 P23975 1/20 0.37
PDE4A P27815 1/20 0.37

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
SCHEMBL16740734 0.92 BMI1 (0.50) DHFRAGPAT2BMI1ALDH1A1NPC1
SCHEMBL16740799 0.92 BMI1 (0.44) DHFRAGPAT2BMI1ALDH1A1NPC1
SCHEMBL16740830 0.90 BMI1 (0.42) DHFRAGPAT2BMI1ALDH1A1EGFR
SCHEMBL16740718 0.88 BMI1 (0.47) DHFRBMI1ALDH1A1NPC1CYP1A2
SCHEMBL16740754 0.88 BMI1 (0.55) DHFRAGPAT2BMI1ALDH1A1KDM4E
SCHEMBL16740755 0.86 BMI1 (0.57) DHFRBMI1ALDH1A1NPC1RAB9A
SCHEMBL16740714 0.85 BMI1 (0.50) BMI1ALDH1A1NPC1RAB9AKDM4E
SCHEMBL16748617 0.84 BMI1 (0.52) DHFRAGPAT2BMI1ALDH1A1NPC1
SCHEMBL16748421 0.83 AGPAT2 (0.41) DHFRAGPAT2BMI1ALDH1A1NPC1
SCHEMBL16740728 0.82 BMI1 (0.50) DHFRAGPAT2BMI1ALDH1A1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US claimed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US claimed
WO-2015076801-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 WO claimed
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US disclosed
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US disclosed
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US disclosed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US disclosed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US disclosed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US disclosed
WO-2015076801-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 WO disclosed
WO-2015076801-A1 SUBSTITUTED TRIAZINE 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 (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-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B DHFR 4017/4885AGPAT2 3973/4885BMI1 1/4885

“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.