SCHEMBL22280537

SCHEMBL22280537

CC(C)(c1cccc(C(C)(C)c2ccc(N)c(Cl)c2)c1)c1ccc(N)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.50
ESR1 P03372 3/20 0.50
CYP3A4 P08684 6/20 0.43
TSHR P16473 6/20 0.43
ALDH1A1 P00352 5/20 0.42
MAPK1 P28482 1/20 0.42
CNR1 P21554 3/20 0.38
CNR2 P34972 3/20 0.38
RECQL P46063 2/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36

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
SCHEMBL25671352 0.93 ESR2 (0.49) ESR2ESR1CYP3A4TSHRALDH1A1
SCHEMBL2811051 0.92 TSHR (0.50) ESR2ESR1CYP3A4TSHRALDH1A1
SCHEMBL11019379 0.91 CNR1 (0.47) ESR2ESR1CYP3A4TSHRALDH1A1
SCHEMBL22280536 0.90 CYP3A4 (0.48) ESR2ESR1CYP3A4TSHRALDH1A1
SCHEMBL10447989 0.80 ESR1 (0.53) ESR2ESR1CYP3A4TSHRALDH1A1
SCHEMBL30279249 0.79 ALDH1A1 (0.52) ESR2CYP3A4TSHRALDH1A1MAPK1
SCHEMBL2963375 0.79 ALDH1A1 (0.52) ESR2CYP3A4TSHRALDH1A1MAPK1
SCHEMBL25670909 0.78 ESR1 (0.33) ESR2ESR1
SCHEMBL9612031 0.78 TSHR (0.48) ESR2CYP3A4TSHRALDH1A1MAPK1
SCHEMBL4467655 0.77 ESR1 (0.60) ESR2ESR1CYP3A4TSHRALDH1A1

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
EP-3583150-B1 GLYCIDYL AMINE EPOXY RESINS BASED ON AMES NEGATIVE AMINES ADITYA BIRLA CHEMICALS THAILAND LTD (TH) 2023-06-07 EP disclosed
US-11548976-B2 Glycidyl amine epoxy resins based on AMES negative amines ADITYA BIRLA CHEMICALS (THAILAND) LIMITED (TH) 2023-01-10 US disclosed
US-20200239624-A1 GLYCIDYL AMINE EPOXY RESINS BASED ON AMES NEGATIVE AMINES ADITYA BIRLA CHEMICALS (THAILAND) LIMITED (TH) 2020-07-30 US disclosed