SCHEMBL9469840

SCHEMBL9469840

CSC1(C)C(=O)N(c2ccccc2)c2ncccc21

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 3/20 0.42
▸ MARK3 P27448 1/20 0.41
▸ PGR P06401 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.37
▸ ELANE P08246 3/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ CACNA1B Q00975 1/20 0.34
▸ APBA1 Q02410 1/20 0.34
▸ AR P10275 1/20 0.34
▸ NPSR1 Q6W5P4 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
SCHEMBL9469343 0.86 EGLN1 (0.41) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL9469392 0.82 PGR (0.56) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL9469489 0.80 EGLN1 (0.43) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL1150372 0.77 EGLN1 (0.42) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL4686921 0.76 ITGAL (0.42) EGLN1MARK3PGRALDH1A1MEN1
SCHEMBL9839213 0.76 ELANE (0.59) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL9469981 0.74 PGR (0.41) EGLN1MARK3PGRELANE
SCHEMBL9469196 0.72 PGR (0.40) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL9981596 0.71 PGR (0.57) EGLN1MARK3PGRALDH1A1ELANE
SCHEMBL1699202 0.70 PGR (0.43) EGLN1MARK3PGRELANEMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5182289-A Pyrrolo 2,3-b!Pyridin-2-one Derivatives SCHERING CORPORATION (US) 1993-01-26 — — US claimed
EP-0419561-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1991-04-03 — — EP claimed
WO-1989012637-A1 HETEROBICYCLIC COMPOUNDS HAVING ANTIINFLAMMATORY ACTIVITY SCHERING CORPORATION (US) 1989-12-28 — — WO claimed
EP-0347698-A1 Heterobicyclic compounds having antiinflammatory activity SCHERING CORPORATION (US) 1989-12-27 — — EP claimed
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