SCHEMBL23287985

SCHEMBL23287985

Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1ncc(C#Cc2ccccc2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 3/20 0.40
▸ BLK P51451 1/20 0.40
▸ BRAF P15056 8/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ LCK P06239 4/20 0.39
▸ KDR P35968 2/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ EGLN1 Q9GZT9 1/20 0.38
▸ MAPK14 Q16539 2/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ KIT P10721 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ NAMPT P43490 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ PPARG P37231 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ NR1H4 Q96RI1 1/20 0.37

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
SCHEMBL27240085 0.92 KDR (0.41) LCKKDREGLN1CA12CA1
SCHEMBL23287990 0.92 MEN1 (0.39) CYP2C9EGLN1PPARGPPARANR1H4
SCHEMBL27240039 0.88 KDR (0.41) BRAFLCKKDREGLN1NAMPT
SCHEMBL27240225 0.86 SYK (0.37) LCKKDREGLN1RXFP1
SCHEMBL27240046 0.84 MEN1 (0.40) EGLN1NAMPTRXFP1PPARGPPARA
SCHEMBL27240069 0.83 CSF1R (0.40) NAMPTPPARG
SCHEMBL27240101 0.83 CSF1R (0.47) BRAFNAMPTPPARG
SCHEMBL23287969 0.83 GRM5 (0.45) EGLN1PPARG
SCHEMBL23273761 0.82 CSF1R (0.42) —
SCHEMBL27240078 0.82 GRM5 (0.51) —

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
US-20240190824-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2024-06-13 — — US disclosed
WO-2021080013-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2021-04-29 — — 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 (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-20240190824-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION KCNJ11, KCNJ1, KCNJ2 BTK 3442/4885BLK 230/4885BRAF 1738/4885

“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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