SCHEMBL11760339

SCHEMBL11760339

CCc1c(C)c(C=O)c(CC)c(CC)c1C=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.37
▸ IGF1R P08069 1/20 0.34
▸ SRC P12931 1/20 0.34
▸ AXL P30530 1/20 0.34
▸ PTK2 Q05397 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ ALK Q9UM73 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL15910152 0.85 IGF1R (0.34) MAOBIGF1RSRCAXLPTK2
SCHEMBL10084874 0.78 ALDH1A1 (0.32) IGF1RSRCAXLPTK2AURKB
SCHEMBL19253784 0.78 MAOB (0.36) MAOBIGF1RSRCAXLPTK2
SCHEMBL16271963 0.78 IGF1R (0.31) MAOBIGF1RSRCAXLPTK2
SCHEMBL31156341 0.74 MAOB (0.43) MAOBIGF1RSRCAXLPTK2
SCHEMBL31156359 0.74 MAOB (0.43) MAOBIGF1RSRCAXLPTK2
SCHEMBL18077441 0.73 HPGD (0.39) MAOBIGF1RSRCAXLPTK2
SCHEMBL3269286 0.73 PGK1 (0.35) MAOBIGF1RSRCAXLPTK2
SCHEMBL29818609 0.70 ALDH1A1 (0.33) SRCSMN1; SMN2
SCHEMBL3267759 0.70 SMN1; SMN2 (0.38) SMN1; SMN2

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
US-4017313-A Photosensitive composition containing a leuco dye, a photosensitizer, an aromatic aldehyde and a secondary or tertiary amine and the use thereof in a direct-print process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-12 — — US disclosed
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