SCHEMBL13813463

SCHEMBL13813463

CNC(=O)n1cc(-c2cc(C(=O)Nc3ccc(CN4CCN(C)CC4)c(CF)c3)ccc2C)cn1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 6/20 0.51
▸ CSF1R P07333 4/20 0.51
▸ BRAF P15056 7/20 0.49
▸ KDR P35968 2/20 0.49
▸ DDR2 Q16832 2/20 0.49
▸ RET P07949 1/20 0.48
▸ EGFR P00533 5/20 0.48
▸ ABL1 P00519 3/20 0.47
▸ LCK P06239 1/20 0.47
▸ ERBB4 Q15303 1/20 0.47
▸ MAPK14 Q16539 1/20 0.47
▸ BCR P11274 1/20 0.46

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
SCHEMBL13813533 0.89 KIT (0.64) KITCSF1RBRAFKDRRET
SCHEMBL13813459 0.82 ABL1 (0.53) KITCSF1RBRAFKDRDDR2
SCHEMBL13813508 0.76 KIT (0.77) KITCSF1RBRAFKDRABL1
SCHEMBL12851923 0.75 ABL1 (0.75) KITKDRABL1
SCHEMBL10265606 0.74 ABL1 (0.64) KITCSF1RBRAFKDRDDR2
SCHEMBL13772031 0.73 BRAF (0.79) KITCSF1RBRAFRETEGFR
SCHEMBL31620780 0.72 KIT (0.64) KITCSF1RBRAFKDRRET
SCHEMBL13771723 0.72 RET (0.83) KITCSF1RBRAFRETEGFR
SCHEMBL14086313 0.72 EGFR (0.54) KITBRAFEGFRABL1BCR
SCHEMBL13772005 0.71 BRAF (0.69) KITCSF1RBRAFRETEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149471-A1 Monocyclic Heterocyclic Compounds ARIAD PHARMACEUTICALS, INC. 2009-06-11 — — 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-20090149471-A1 Monocyclic Heterocyclic Compounds CYP11B2, CYP3A5, CYP1A2 KIT 813/4885CSF1R 3401/4885BRAF 2370/4885

“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