SCHEMBL373192

SCHEMBL373192

CCc1cccc(-c2[nH]c(N(C)c3cccc(C(N)=O)c3)nc2-c2ccc3nccnc3c2)n1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 19/20 0.66
MAPK14 Q16539 5/20 0.55
KDR P35968 2/20 0.55
RIPK2 O43353 1/20 0.55
ACVR1B P36896 1/20 0.55
PDGFRA P16234 1/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
PRKD1 Q15139 1/20 0.48
MTOR P42345 1/20 0.41
CHEK2 O96017 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
SCHEMBL373274 0.92 TGFBR1 (0.68) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL373425 0.89 TGFBR1 (0.67) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL373361 0.84 TGFBR1 (0.67) TGFBR1MAPK14RIPK2ACVR1BPRKD1
SCHEMBL373272 0.83 TGFBR1 (0.65) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL14086514 0.81 TGFBR1 (0.82) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL373176 0.81 TGFBR1 (0.65) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL14086524 0.81 TGFBR1 (0.74) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL373722 0.80 TGFBR1 (0.67) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL373193 0.79 TGFBR1 (1.00) TGFBR1MAPK14KDRRIPK2ACVR1B
SCHEMBL14086505 0.79 TGFBR1 (0.77) TGFBR1MAPK14KDRRIPK2ACVR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871744-B2 Compounds and methods for selectively targeting tumor-associated mucins B & G Partyers, LLC (US) 2014-10-28 US disclosed
US-20120022016-A1 Compounds and methods for selectively targeting tumor-associated mucins B&G PARTNERS, LLC 2012-01-26 US disclosed
EP-2409708-A1 Compounds and methods for selectively targeting tumor-associated mucins B & G Partners, LLC (US) 2012-01-25 EP 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-20120022016-A1 Compounds and methods for selectively targeting tumor-associated mucins MUC1, NEU4, ALK TGFBR1 1324/4885MAPK14 2025/4885KDR 547/4885

“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.