SCHEMBL9967392

SCHEMBL9967392

Cc1cccc(C(=O)Nc2ccc(C)c(Nc3nn(C)cc3-c3cc(NC4CC4)ncn3)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.47
INSR P06213 3/20 0.47
LCK P06239 3/20 0.47
LYN P07948 3/20 0.47
SRC P12931 3/20 0.47
HCK P08631 2/20 0.47
MAPK14 Q16539 4/20 0.47
BRAF P15056 9/20 0.45
TEK Q02763 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL3589391 0.90 KDR (0.59) KDRINSRLCKLYNSRC
SCHEMBL9967389 0.85 KDR (0.47) KDRINSRLCKLYNSRC
SCHEMBL9967393 0.83 INSR (0.57) KDRINSRLCKLYNSRC
SCHEMBL9967394 0.82 MAPK14 (0.53) KDRINSRLCKLYNSRC
SCHEMBL3589285 0.80 BRAF (0.60) KDRINSRLCKLYNSRC
SCHEMBL9970944 0.80 BRAF (0.47) KDRINSRLCKLYNSRC
SCHEMBL9970874 0.78 BRAF (0.41) KDRINSRLCKLYNSRC
SCHEMBL9967408 0.78 INSR (0.52) KDRINSRLCKLYNSRC
SCHEMBL3824880 0.78 KDR (0.74) KDRINSRLCKLYNSRC
SCHEMBL3585148 0.78 BRAF (0.52) KDRINSRLCKLYNSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK KDR 13/4885INSR 931/4885LCK 3/4885

“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.