SCHEMBL12368482

SCHEMBL12368482

CC(C)Nc1cc(Cl)cnc1Cl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 1/20 0.39
▸ IRAK4 Q9NWZ3 11/20 0.36
▸ NR4A2 P43354 2/20 0.36
▸ GAA P10253 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ AOC1 P19801 1/20 0.33
▸ AOC3 Q16853 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
SCHEMBL8084512 0.81 KAT2B (0.37) KAT2BNR4A2GAATDP1PIK3CD
SCHEMBL1621716 0.81 KAT2B (0.37) KAT2BIRAK4NR4A2GAATDP1
SCHEMBL12393156 0.77 CHUK (0.39) KAT2BGAAPIK3CDPIK3CAPIK3CB
SCHEMBL20688201 0.77 TYK2 (0.43) KAT2BIRAK4NR4A2AOC1AOC3
SCHEMBL14243611 0.77 SMN1; SMN2 (0.44) GAA
SCHEMBL3669943 0.75 LRRK2 (0.38) KAT2BIRAK4
SCHEMBL3644982 0.73 PIK3CD (0.34) KAT2BIRAK4PIK3CDPIK3CAPIK3CB
SCHEMBL20697016 0.72 TYK2 (0.44) —
SCHEMBL8007654 0.72 CRHR1 (0.48) IRAK4GAATDP1
SCHEMBL15781884 0.71 PDE10A (0.41) GAATDP1

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-7998987-B2 Inhibitors of c-Met and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-08-16 — — US disclosed
US-20100190774-A1 INHIBITORS OF C-MET AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-07-29 — — US disclosed
US-7728017-B2 Inhibitors of c-Met and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-01 — — 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-20100190774-A1 INHIBITORS OF C-MET AND USES THEREOF MET, HGF, ABL1 KAT2B 3639/4885IRAK4 1155/4885NR4A2 3594/4885

“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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