SCHEMBL3484639

SCHEMBL3484639

Cc1ncc(Oc2ccc(N)cc2Cl)cc1C(=O)NC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.42
PNLIP P16233 2/20 0.41
KMT2A Q03164 1/20 0.39
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
SCN9A Q15858 6/20 0.38
LRRK2 Q5S007 1/20 0.38
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
PARG Q86W56 1/20 0.36
STK39 Q9UEW8 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
ACACB O00763 1/20 0.35
SCN2B O60939 1/20 0.35
SCN1A P35498 1/20 0.35
SCN1B Q07699 1/20 0.35
SCN5A Q14524 1/20 0.35
NR1H4 Q96RI1 1/20 0.34

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
SCHEMBL3484630 0.83 MEN1 (0.50) KMT2ATDP1
SCHEMBL3485177 0.83 ACACB (0.43) GRM4PNLIPKMT2AEGFRERBB2
SCHEMBL3506314 0.81 POLB (0.48) PNLIPKMT2ASCN9APOLBAPEX1
SCHEMBL3484355 0.80 EGFR (0.41) GRM4PNLIPEGFRERBB2NR1H4
SCHEMBL3484557 0.78 ANO1 (0.45) KMT2AEGFRERBB2
SCHEMBL3505758 0.75 EGFR (0.52) KMT2AEGFRERBB2POLBSTK39
SCHEMBL3484176 0.74 EGLN1 (0.38) GRM4ACACB
SCHEMBL3483863 0.74 EGFR (0.75) EGFRERBB2
SCHEMBL3483771 0.73 EGFR (0.39) GRM4PNLIPKMT2AEGFRERBB2
SCHEMBL28880745 0.73 PNLIP (0.46) PNLIPKMT2APOLBTDP1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004238-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
CN-101611041-A Condensed heterocyclic compouds TAKEDA PHARMACEUTICAL (JP) 2009-12-23 CN disclosed
EP-2103620-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-09-23 EP 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-20100004238-A1 FUSED HETEROCYCLIC COMPOUND ERBB2, ROS1, FLT3 GRM4 1300/4885PNLIP 4767/4885KMT2A 300/4885

“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.