SCHEMBL15859862

SCHEMBL15859862

CC(=O)c1cc2cc(NCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)c(C(F)(F)F)c4)ccc3F)cnc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.55
▸ BCR P11274 3/20 0.55
▸ EGFR P00533 9/20 0.55
▸ BRAF P15056 9/20 0.55
▸ FGFR1 P11362 2/20 0.53
▸ KDR P35968 1/20 0.53
▸ CYP2C9 P11712 1/20 0.52
▸ PDGFRA P16234 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ FLT3 P36888 1/20 0.52
▸ LRRK2 Q5S007 1/20 0.52
▸ HDAC6 Q9UBN7 1/20 0.52
▸ KIT P10721 1/20 0.52
▸ RET P07949 1/20 0.52

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
SCHEMBL17321174 0.94 ABL1 (0.56) ABL1BCREGFRBRAFFGFR1
SCHEMBL15859861 0.93 BRAF (0.60) ABL1BCREGFRBRAFFGFR1
SCHEMBL15859863 0.89 BRAF (0.52) ABL1BCREGFRBRAFFGFR1
SCHEMBL15859839 0.89 EGFR (0.58) ABL1BCREGFRBRAFKIT
SCHEMBL31060809 0.88 BRAF (0.59) ABL1BCREGFRBRAFFGFR1
SCHEMBL15859828 0.88 BRAF (0.59) ABL1BCREGFRBRAFFGFR1
SCHEMBL15859838 0.88 CSK (0.54) ABL1BCRBRAFRET
SCHEMBL17420213 0.88 CSK (0.54) ABL1BCRBRAFRET
SCHEMBL15859803 0.88 BRAF (0.59) ABL1BCREGFRBRAFFGFR1
SCHEMBL17420244 0.88 EGFR (0.52) ABL1EGFRBRAFKITRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403823-B2 Protein kinase inhibitors ORIBASE PHARMA (FR) 2016-08-02 — — US disclosed
US-9403823-B2 Protein kinase inhibitors ORIBASE PHARMA (FR) 2016-08-02 — — US disclosed
US-20160009709-A1 PROTEIN KINASE INHIBITORS ORIBASE PHARMA (FR) 2016-01-14 — — US disclosed
US-20160009709-A1 PROTEIN KINASE INHIBITORS ORIBASE PHARMA (FR) 2016-01-14 — — US disclosed
WO-2014102376-A1 PROTEIN KINASE INHIBITORS ORIBASE PHARMA (FR) 2014-07-03 — — 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-20160009709-A1 PROTEIN KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K2 ABL1 128/4885BCR 1053/4885EGFR 738/4885

“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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