SCHEMBL4632329

SCHEMBL4632329

CC(C)c1cc[c]c(O)c1C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.38
GABRB1 P18505 4/20 0.38
GABRB2 P47870 3/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
LMNA P02545 2/20 0.38
SLC6A2 P23975 2/20 0.38
HTR2B P41595 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
FAAH O00519 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
PTGS1 P23219 1/20 0.38
HTR2C P28335 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38

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
SCHEMBL28093180 0.80 GABRA1 (0.33) GABRA1GABRB1GABRB2CA1CA2
SCHEMBL157221 0.76 FAAH (0.30) GABRA1GABRB1GABRB2CA1CA2
SCHEMBL2138025 0.74
SCHEMBL3236614 0.74 GABRA1 (0.31) GABRA1GABRB1
SCHEMBL315614 0.71 GABRA1 (0.50) GABRA1GABRB1GABRB2CA1CA2
SCHEMBL28000032 0.71
SCHEMBL9244695 0.70 GABRA1 (0.48) GABRA1GABRB1GABRB2CA1CA2
SCHEMBL28035681 0.69 TYR (0.39) LMNASLC6A2CYP3A4HPGDTSHR
SCHEMBL9933562 0.68 GABRA1 (0.32) GABRA1GABRB2
SCHEMBL10611980 0.67 GABRA1 (0.56) GABRA1GABRB1GABRB2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1927098-A2 ILLUMINATING DEVICE COMBINING A WHITE LED AND A DIFFUSING SHEET ARKEMA France (FR) 2008-06-04 EP claimed
WO-2006100127-A2 ILLUMINATING DEVICE COMBINING A WHITE LED AND A DIFFUSING SHEET ARKEMA FRANCE (FR) 2006-09-28 WO claimed
EP-0324431-B1 NEW INDOLYLPIPERIDINE COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-25 EP disclosed
US-5017703-A Antiallergens, antiinflammatory FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1991-05-21 US disclosed
US-4935432-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-06-19 US disclosed
EP-0324431-A1 New indolylpiperidine compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-07-19 EP disclosed
US-4629733-A CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1986-12-16 US disclosed