SCHEMBL10923229

SCHEMBL10923229

O=C1CCc2c(ncc3ccccc23)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 5/20 0.43
▸ DDB1 Q16531 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ PRKCI P41743 1/20 0.42
▸ PDE4B Q07343 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP2C19 P33261 3/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ CYP11B1 P15538 2/20 0.42
▸ CYP11B2 P19099 2/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2B6 P20813 1/20 0.42
▸ CDK5 Q00535 2/20 0.39
▸ CHEK1 O14757 1/20 0.39
▸ AURKA O14965 1/20 0.39
▸ DAPK3 O43293 1/20 0.39
▸ PRKD3 O94806 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39

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
SCHEMBL25852792 0.85 CDK5 (0.46) CRBNDDB1ALDH1A1HSD17B10PARP1
SCHEMBL7594487 0.77 CYP11B1 (0.42) CRBNDDB1ALDH1A1HSD17B10PARP1
SCHEMBL10919563 0.75 CRBN (0.38) CRBNDDB1ALDH1A1HSD17B10PARP1
SCHEMBL18576434 0.73 KDM4E (0.47) ALDH1A1HSD17B10PARP1PRKCIPDE4B
SCHEMBL10379077 0.72 UHRF1 (0.40) ALDH1A1HSD17B10PARP1PRKCIPDE4B
SCHEMBL8944351 0.71 CYP2C19 (0.47) CRBNDDB1ALDH1A1HSD17B10CYP2C19
SCHEMBL10923189 0.70 TP53 (0.39) CRBNDDB1ALDH1A1HSD17B10PARP1
SCHEMBL10526975 0.70 CCNB2 (0.42) CRBNDDB1PARP1TDP1CDK5
SCHEMBL29374271 0.67 ACHE (0.46) ALDH1A1HSD17B10TDP1CYP2C19CYP2D6
SCHEMBL8088682 0.67 ACHE (0.46) ALDH1A1HSD17B10CYP2C19CYP2D6KDM4E

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
EP-0167045-A1 Benzo[c][1,8]naphthyridines, process for their preparation and their use, and compositions containing these compounds Beiersdorf Aktiengesellschaft (DE) 1986-01-08 — — EP claimed
EP-0167045-A1 Benzo[c][1,8]naphthyridines, process for their preparation and their use, and compositions containing these compounds Beiersdorf Aktiengesellschaft (DE) 1986-01-08 — — EP disclosed
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