SCHEMBL31351736

SCHEMBL31351736

Nc1ccc2c(c1)C1(CC1)CNC2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 3/20 0.40
▸ CDC7 O00311 4/20 0.38
▸ DBF4 Q9UBU7 3/20 0.38
▸ CA9 Q16790 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CASP1 P29466 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ NPC1 O15118 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ LMNA P02545 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ GAA P10253 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
SCHEMBL22855207 0.87 CDC7 (0.38) TDP2CDC7DBF4CA9CA12
SCHEMBL22855430 0.81 CDC7 (0.41) TDP2CDC7DBF4CA9CA12
SCHEMBL31351723 0.80 CDC7 (0.43) TDP2CDC7CA9CA12CASP1
SCHEMBL31351722 0.80 TDP2 (0.40) TDP2CDC7CA9CA12CASP1
SCHEMBL31351716 0.80 CDC7 (0.43) TDP2CDC7CA9CA12CASP1
SCHEMBL24457369 0.80 PARP10 (0.46) TDP2MAPTMAPKAPK2PARP1KMT2A
SCHEMBL12077241 0.80 TDP2 (0.46) TDP2CDC7DBF4CA9ALDH1A1
SCHEMBL24457584 0.76 PARP10 (0.50) TDP2CDC7DBF4MAPKAPK2PARP1
SCHEMBL24457763 0.76 CDC7 (0.33) CDC7DBF4HSD17B10HPGDPARP1
SCHEMBL29551627 0.76 CDC7 (0.32) CDC7DBF4PARP1

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
EP-4747244-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE Redx Pharma Limited (GB) 2026-05-27 — — EP disclosed
WO-2025017305-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2025-01-23 — — WO disclosed
WO-2025017306-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2025-01-23 — — WO disclosed
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