SCHEMBL30865644

SCHEMBL30865644

CC1C=CC=CC1(C)O.O=C(O)C=Cc1ccc2c(c1C=CC(=O)O)Cc1ccccc1-2

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MITF O75030 1/20 0.31
HSP90AA1 P07900 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
SCHEMBL30249062 0.82 CYP1A2 (0.42) RAB9ANPC1CYP1A2CYP3A4HSD17B10
Alcohol SCHEMBL30689895 0.79 RAB9A (0.39) RAB9ANPC1CYP1A2CYP3A4HSD17B10
Phenol SCHEMBL29434002 0.78 CA1 (0.41) RAB9ANPC1CYP1A2CYP3A4HSD17B10
Orthocresol SCHEMBL29473411 0.75 NFKB1 (0.43) RAB9ANPC1CYP1A2CYP3A4HSD17B10
SCHEMBL29436954 0.73 HTT (0.36) RAB9ANPC1CYP1A2CYP3A4HSD17B10
1-Naphthol SCHEMBL31499454 0.72 CA1 (0.41) RAB9ANPC1CYP1A2CYP3A4HSD17B10
SCHEMBL29676550 0.70 HTT (0.36) RAB9ANPC1CYP1A2CYP3A4HSD17B10
Fumaric Acid SCHEMBL30909567 0.69 TSHR (0.33)
SCHEMBL31132409 0.69 CA1 (0.49) RAB9ANPC1CYP1A2CYP3A4HSD17B10
SCHEMBL31499453 0.68 P2RX3 (0.35) RAB9ANPC1CYP1A2CYP3A4HSD17B10

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
CN-117916664-A Photosensitive composition, cured product, and organic EL display device 东丽株式会社 2024-04-19 CN disclosed