SCHEMBL13878743

SCHEMBL13878743

CCN1CCN(c2cc(C(=O)Nc3ccc(C)c(NC(=O)c4cnc(Nc5cc(NC6CC6)nc(C)n5)s4)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LYN P07948 2/20 0.51
▸ INSR P06213 1/20 0.51
▸ LCK P06239 1/20 0.51
▸ HCK P08631 1/20 0.51
▸ SRC P12931 1/20 0.51
▸ KDR P35968 1/20 0.51
▸ ABL1 P00519 3/20 0.50
▸ BCR P11274 3/20 0.50
▸ HDAC1 Q13547 3/20 0.50
▸ BRAF P15056 9/20 0.48
▸ CSF1R P07333 7/20 0.48
▸ RAF1 P04049 5/20 0.48
▸ AURKA O14965 1/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ NTRK1 P04629 1/20 0.45
▸ DDR1 Q08345 1/20 0.45

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
SCHEMBL13878749 0.92 LYN (0.53) LYNINSRLCKHCKSRC
SCHEMBL13878736 0.92 LYN (0.54) LYNINSRLCKHCKSRC
SCHEMBL13878745 0.91 ABL1 (0.61) LYNINSRLCKHCKSRC
SCHEMBL1704685 0.90 RAF1 (0.54) LYNINSRLCKHCKSRC
SCHEMBL13878744 0.88 BRAF (0.61) LYNINSRLCKHCKSRC
SCHEMBL13878748 0.87 LYN (0.48) LYNINSRLCKHCKSRC
SCHEMBL13878805 0.86 LYN (0.55) LYNINSRLCKHCKSRC
SCHEMBL13878752 0.86 CSF1R (0.57) LYNLCKHCKSRCKDR
SCHEMBL13878787 0.85 BRAF (0.54) LYNINSRLCKHCKSRC
SCHEMBL13878750 0.84 ABL1 (0.56) LYNINSRLCKHCKSRC

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-20090105250-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-23 — — US disclosed
US-20090105250-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-23 — — 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-20090105250-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS ABL1, BCR, PDGFRB LYN 40/4885INSR 1466/4885LCK 56/4885

“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.

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