SCHEMBL4011241

SCHEMBL4011241

On1cncc1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.52
CYP11B2 P19099 6/20 0.52
IDO1 P14902 4/20 0.52
LDLR P01130 1/20 0.45
PCSK9 Q8NBP7 1/20 0.45
HPGDS O60760 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GLO1 Q04760 2/20 0.40
BRD9 Q9H8M2 1/20 0.40
SRC P12931 1/20 0.39
ATM Q13315 1/20 0.38
KDR P35968 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL5966768 0.74 CYP11B1 (0.52) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL16152320 0.74 CYP11B1 (0.52) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL27794049 0.74 CYP11B1 (0.52) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL12676744 0.74 CYP11B1 (0.52) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL972964 0.74 HPGDS (0.73) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL28785096 0.74 CYP11B1 (0.56) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL12676747 0.72 CYP11B1 (0.50) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL1951361 0.71 CYP11B1 (0.62) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL23252453 0.70 CYP11B1 (0.60) CYP11B1CYP11B2IDO1LDLRPCSK9
SCHEMBL5324373 0.70 CYP11B1 (0.60) CYP11B1CYP11B2IDO1HPGDSL3MBTL1

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-2041095-A1 NOVEL TYROSINASE INHIBITORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2009-04-01 EP disclosed
WO-2008006824-A1 NOVEL TYROSINASE INHIBITORS, THEIR PROCESS OF PREPARATION AND THEIR USE IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-17 WO disclosed