SCHEMBL10071823

SCHEMBL10071823

CCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(-c4cc5cnc(C)cc5n(C)c4=O)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 3/20 0.55
▸ MAP3K7 O43318 2/20 0.55
▸ MAP4K2 Q12851 2/20 0.55
▸ MAP3K20 Q9NYL2 2/20 0.55
▸ NR2C2 P49116 3/20 0.54
▸ BTK Q06187 2/20 0.54
▸ HTT P42858 3/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ HCK P08631 3/20 0.54
▸ CLK1 P49759 1/20 0.53
▸ EGFR P00533 1/20 0.53
▸ BRAF P15056 1/20 0.53

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
SCHEMBL14011570 0.92 NR2C2 (0.59) MAPK14MAP3K7MAP4K2MAP3K20NR2C2
SCHEMBL10043661 0.86 SYK (0.55) MAPK14MAP4K2HTTBRAF
SCHEMBL1134923 0.85 MAPK14 (0.63) MAPK14MAP3K7MAP4K2MAP3K20ATM
SCHEMBL10043751 0.84 SYK (0.53) MAPK14MAP4K2BRAF
SCHEMBL10043758 0.83 LCK (0.53) MAPK14MAP4K2BTKBRAF
SCHEMBL502521 0.83 BRAF (0.61) MAP4K2HCKBRAF
SCHEMBL14011585 0.82 BRAF (0.50) MAPK14MAP3K7MAP4K2MAP3K20NR2C2
SCHEMBL10043720 0.81 SYK (0.47) MAPK14MAP4K2HTTBRAF
SCHEMBL4869570 0.80 MAPK14 (0.60) MAPK14MAP3K7MAP4K2MAP3K20NR2C2
SCHEMBL4879660 0.80 EGFR (0.58) MAPK14MAP3K7MAP4K2MAP3K20NR2C2

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-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 — — US disclosed
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2010-04-01 — — US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 — — US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 — — US disclosed
US-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-07-24 — — 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 (2 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-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC MAPK14 117/4885MAP3K7 21/4885MAP4K2 17/4885
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC MAPK14 117/4885MAP3K7 21/4885MAP4K2 17/4885

“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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