SCHEMBL27364232

SCHEMBL27364232

CC(=O)c1cnn(Cc2ccc(C)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 12/20 0.53
▸ HSD17B10 Q99714 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.47
▸ LMNA P02545 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KLK1 P06870 1/20 0.44

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
SCHEMBL19300037 0.89 HSD17B10 (0.51) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL948453 0.88 HSD17B10 (0.61) KLKB1HSD17B10ALDH1A1LMNAPOLB
SCHEMBL949612 0.88 KLKB1 (0.53) KLKB1HSD17B10ALDH1A1LMNAPOLB
SCHEMBL17229366 0.88 KLKB1 (0.51) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL27286142 0.86 HSD17B10 (0.68) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL752774 0.86 LMNA (0.61) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL17696410 0.86 KLKB1 (0.55) KLKB1HSD17B10ALDH1A1LMNAPOLB
SCHEMBL13692389 0.86 L3MBTL1 (0.54) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL19299983 0.84 KLKB1 (0.47) KLKB1HSD17B10ALDH1A1LMNAHTT
SCHEMBL27259482 0.84 KLKB1 (0.51) KLKB1HSD17B10ALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 — — WO disclosed
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