SCHEMBL1705565

SCHEMBL1705565

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1-c1cnc2sc(N)nc2c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 11/20 0.65
MAPK14 Q16539 10/20 0.65
KDR P35968 10/20 0.65
JAK3 P52333 5/20 0.65
TEK Q02763 5/20 0.65
BRAF P15056 3/20 0.60
DDR2 Q16832 3/20 0.58
KIT P10721 6/20 0.56
RAF1 P04049 2/20 0.54
SRC P12931 2/20 0.53
ABL1 P00519 1/20 0.53
BCR P11274 1/20 0.53
DDR1 Q08345 1/20 0.53
CSF1R P07333 1/20 0.51
BTK Q06187 1/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL10159643 0.85 TRPV1 (0.48) LCKMAPK14KDRJAK3TEK
SCHEMBL13219723 0.83 LCK (0.76) LCKMAPK14KDRJAK3TEK
SCHEMBL13220068 0.82 KDR (0.74) LCKMAPK14KDRJAK3TEK
SCHEMBL13220047 0.82 KDR (0.69) LCKMAPK14KDRJAK3TEK
SCHEMBL1704008 0.82 MAPK14 (0.44) LCKMAPK14KDRJAK3TEK
SCHEMBL1704882 0.80 MAPK14 (0.68) LCKMAPK14KDRBRAFRAF1
SCHEMBL1704606 0.80 ABL1 (0.49) MAPK14RAF1ABL1CSF1RMAPT
SCHEMBL13220176 0.80 MAPK14 (0.62) LCKMAPK14KDRJAK3TEK
SCHEMBL5491324 0.79 KDR (0.65) LCKMAPK14KDRJAK3TEK
SCHEMBL19328015 0.79 CSF1R (0.63) LCKMAPK14KDRJAK3TEK

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-9505784-B2 Fused 2-aminothiazole compounds DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-11-29 US disclosed
US-20150094315-A1 FUSED 2-AMINOTHIAZOLE COMPOUNDS DANA-FARBER CANCER INSTITUTE, INC. (US) 2015-04-02 US disclosed
US-8765747-B2 Fused 2-aminothiazole compounds DANA-FARBER CANCER INSTITUTE, INC. (US) 2014-07-01 US disclosed
US-20120088766-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES DANA-FARBER CANCER INSTITUTE, INC. (US) 2012-04-12 US disclosed
WO-2010144909-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-16 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 (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-20120088766-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USES OAT, OTC, DLD LCK 1107/4885MAPK14 4759/4885KDR 1877/4885
US-20150094315-A1 FUSED 2-AMINOTHIAZOLE COMPOUNDS GOT2, OAT, ABAT LCK 290/4885MAPK14 4735/4885KDR 2363/4885

“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.