SCHEMBL11245975

SCHEMBL11245975

OCCc1ccc(O)c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 8/20 0.56
EP300 Q09472 2/20 0.45
KAT2B Q92831 2/20 0.45
KAT8 Q9H7Z6 2/20 0.45
HDAC3 O15379 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
KDM4E B2RXH2 4/20 0.41
GAA P10253 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LDHA P00338 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX5 P09917 1/20 0.39
MAPT P10636 1/20 0.39
BACE1 P56817 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
SCHEMBL12235264 0.89 TDP1 (0.48) IDO1KDM4EHTTTDP1ALDH1A1
SCHEMBL3588877 0.87 IDO1 (0.44) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL4612497 0.84 IDO1 (0.65) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL17537713 0.84 TDP1 (0.44) KDM4EGAANPC1LMNAHTT
SCHEMBL11742202 0.81 IDO1 (0.54) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL11741406 0.81 IDO1 (0.54) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL1467932 0.81 TAAR1 (0.57) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL17537711 0.80 POLB (0.45) KDM4EGAAHTTTDP1ALDH1A1
SCHEMBL1397170 0.79 IDO1 (0.65) IDO1EP300KAT2BKAT8HDAC3
SCHEMBL29357437 0.79 IDO1 (0.65) IDO1EP300KAT2BKAT8HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4362795-A CONTAINING A 4-ALKOXY-1-NAPHTHOL; X-RAY FILM FUJI PHOTO FILM CO., LTD. (JP) 1982-12-07 US claimed
US-4042635-A Spiro compounds CIBA-GEIGY CORPORATION (US) 1977-08-16 US disclosed
US-3950403-A Spiro compounds CIBA-GEIGY CORPORATION (US) 1976-04-13 US disclosed