SCHEMBL8373596

SCHEMBL8373596

CC(CC(C)(C)C)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.55
ESR2 Q92731 7/20 0.55
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
MIF P14174 1/20 0.47
CYP2C9 P11712 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 2/20 0.45
CYP3A4 P08684 2/20 0.45
AR P10275 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 2/20 0.45
CYP1A2 P05177 1/20 0.45
PGR P06401 1/20 0.45
CHRM2 P08172 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 1/20 0.45
CHRM1 P11229 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL15854207 1.00 ESR1 (0.55) ESR1ESR2PDCD1CD274MIF
SCHEMBL5918492 0.89 RIPK1 (0.46) ESR1ESR2MIFTAAR1RIPK1
SCHEMBL3480352 0.82 SHBG (0.52) ESR1ESR2PDCD1CD274MIF
SCHEMBL22620371 0.82 ESR1 (0.50) ESR1ESR2PDCD1CD274MIF
SCHEMBL903671 0.81 ESR1 (0.54) ESR1ESR2PDCD1CD274CYP2C9
SCHEMBL27951910 0.80 SHBG (0.48) ESR1ESR2PDCD1CD274CYP2C9
SCHEMBL24533708 0.79 GRIA4 (0.38) ESR1ESR2CYP2C9LMNACYP2D6
SCHEMBL11910301 0.78 ADRB2 (0.46) TDP1LMNASLC6A2SLC6A3MAPT
SCHEMBL13980319 0.78 TAAR1 (0.54) ESR1ESR2PDCD1CD274CYP2C9
SCHEMBL28429831 0.78 RIPK1 (0.39) CYP2C9LMNACYP3A4CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007115164-A9 AMINO ACID SURROGATES FOR PEPTIDIC CONSTRUCTS PALATIN TECHNOLOGIES INC (US) 2007-11-29 WO disclosed
WO-2007115164-A2 AMINO ACID SURROGATES FOR PEPTIDIC CONSTRUCTS PALATIN TECHNOLOGIES, INC. (US) 2007-10-11 WO disclosed
EP-0147759-B2 Latex containing odor inhibitors GOODRICH CO B F (US) 1999-05-06 EP disclosed
US-4617230-A AMINE-TYPE ANTIOXIDANTS, HINDERED PHENOLS; CELLULOSE BONDED WITH LATEX, ACRYLATE MONOMERS THE B. F. GOODRICH COMPANY (US) 1986-10-14 US disclosed
EP-0147759-A2 Latex containing odor inhibitors The B.F. GOODRICH Company (US) 1985-07-10 EP disclosed