SCHEMBL7804659

SCHEMBL7804659

CCC(c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc(CC(C)c2ccc(O)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 13/20 0.71
ESR2 Q92731 13/20 0.71
TAAR1 Q96RJ0 3/20 0.44
SLC6A2 P23975 1/20 0.44
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7806613 0.88 ESR1 (0.67) ESR1ESR2TAAR1SLC6A2
SCHEMBL9810145 0.84 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL547164 0.84 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL296781 0.84 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL1171038 0.84 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL7806637 0.83 ESR1 (0.76) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL572776 0.83 ESR1 (0.76) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL10456186 0.83 ESR1 (0.76) ESR1ESR2TAAR1SLC6A2MEN1
Ammonia Solution, Strong SCHEMBL5329244 0.82 ESR1 (0.96) ESR1ESR2TAAR1SLC6A2MEN1
SCHEMBL1842701 0.81 ESR1 (0.85) ESR1ESR2TAAR1SLC6A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6316170-B2 COATING, EXPOSURE, DEVELOPMENT AND HEAT TREATMENT KABUSHIKI KAISHA TOSHIBA (JP) 2001-11-13 US disclosed
US-20010006767-A1 Developing solution and method of forming polyimide pattern by using the developing solution YOSHIAKI KAWAMONZEN 2001-07-05 US disclosed