SCHEMBL8978557

SCHEMBL8978557

COc1ccc(C(=O)c2ccc3c(c2)CC(C)O3)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.63
RAB9A P51151 2/20 0.52
POLB P06746 1/20 0.51
ALDH1A1 P00352 3/20 0.49
GAA P10253 3/20 0.49
GABRA1 P14867 2/20 0.48
GABRB2 P47870 2/20 0.48
MAPT P10636 3/20 0.45
RXFP1 Q9HBX9 3/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HPGD P15428 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 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
SCHEMBL13799417 0.81 HRH3 (0.54) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL29653952 0.80 TDP1 (0.70) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL16742309 0.80 TDP1 (0.70) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL1092598 0.78 TDP1 (0.77) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL8690783 0.78 TDP1 (1.00) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL18133445 0.78 TDP1 (0.67) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL8691132 0.77 TDP1 (0.74) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL10776603 0.74 TDP1 (0.70) TDP1RAB9APOLBALDH1A1GAA
SCHEMBL10366432 0.74 TDP1 (0.65) TDP1RAB9APOLBALDH1A1MAPT
SCHEMBL18084701 0.74 TDP1 (0.60) TDP1RAB9APOLBALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5573712-A PHOTOCHROMIC ARTICLE COMPRISING ORGANIC HOST AND THE PHOTOCHROMIC NAPHTHOPYRAN TRANSITIONS OPTICAL, INC. (US) 1996-11-12 US disclosed
US-5552090-A Photochromic naphthopyran compounds PPG INDUSTRIES, INC. (US) 1996-09-03 US disclosed
US-5458814-A Ophthalmic lenses TRANSITIONS OPTICAL, INC. (US) 1995-10-17 US disclosed
WO-1995016215-A1 NOVEL SUBSTITUTED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1995-06-15 WO disclosed