SCHEMBL3399764

SCHEMBL3399764

Cc1cc(N)ccc1Oc1cccc2sncc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.38
ERBB2 P04626 9/20 0.38
LCK P06239 1/20 0.36
LYN P07948 1/20 0.36
MET P08581 1/20 0.36
SRC P12931 1/20 0.36
CSK P41240 1/20 0.36
MAP2K1 Q02750 1/20 0.36
TEK Q02763 1/20 0.36
ERBB4 Q15303 1/20 0.36
KEAP1 Q14145 1/20 0.36
CSF1R P07333 1/20 0.36
FLT1 P17948 1/20 0.36
RPS6KB1 P23443 1/20 0.36
KDR P35968 1/20 0.36
FLT3 P36888 1/20 0.36
HIPK4 Q8NE63 1/20 0.36
SRPK1 Q96SB4 1/20 0.36
ICAM1 P05362 1/20 0.33
SELE P16581 1/20 0.33

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
SCHEMBL3406597 0.85 GAA (0.39) EGFRERBB2LCKLYNMET
SCHEMBL3406564 0.84 EGFR (0.38) EGFRERBB2LCKLYNMET
SCHEMBL3403550 0.84 EGFR (0.48) EGFRERBB2LCKLYNMET
SCHEMBL3401793 0.84 TRPA1 (0.38) EGFRERBB2LCKLYNMET
SCHEMBL3403858 0.81 CSF1R (0.37) EGFRERBB2LCKLYNMET
SCHEMBL29549546 0.74 ALDH1A1 (0.48) CYP3A4ALDH1A1MEN1NPC1RAB9A
SCHEMBL11029113 0.74 ESRRA (0.43) ALDH1A1
SCHEMBL30473086 0.73 ALDH1A1 (0.56) CYP3A4ALDH1A1MEN1KMT2A
SCHEMBL4329985 0.73 ALDH1A1 (0.56) CYP3A4ALDH1A1MEN1KMT2A
SCHEMBL5552568 0.72 SMN1; SMN2 (0.47) KEAP1ALDH1A1MEN1NPC1RAB9A

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
EP-2253633-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP disclosed
US-20090233937-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-17 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-20090233937-A1 FUSED HETEROCYCLIC COMPOUND ROS1, JAK2, ERBB2 EGFR 11/4885ERBB2 3/4885LCK 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.