SCHEMBL20718672

SCHEMBL20718672

CC(Cc1cc(O)c2cccc(O)c2c1)c1ccc(C(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.39
RXRB P28702 3/20 0.39
RXRG P48443 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
CDC25B P30305 2/20 0.39
ADRB2 P07550 1/20 0.37
CASP3 P42574 1/20 0.37
CASP6 P55212 1/20 0.37
GRIA4 P48058 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
BCL2 P10415 1/20 0.36
SELL P14151 1/20 0.36
SELP P16109 1/20 0.36
SELE P16581 1/20 0.36
ADRB1 P08588 3/20 0.35
ADRB3 P13945 3/20 0.35
AKR1C3 P42330 1/20 0.35
PTGER4 P35408 1/20 0.35

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
SCHEMBL20718687 0.85 ESR1 (0.56) ESR1ESR2KDM4E
SCHEMBL20718705 0.85 PHGDH (0.39) ESR1ESR2ADRB2CASP3CASP6
SCHEMBL20718701 0.77 ESR1 (0.47) RXRARXRBRXRGESR1ESR2
SCHEMBL16428924 0.76 MRGPRX4 (0.55) MRGPRX4
SCHEMBL23071510 0.76 ESR1 (0.52) RXRARXRBESR1ESR2GRIA4
SCHEMBL20718656 0.76 PSEN1 (0.40) ADRB2ADRB1ADRB3
SCHEMBL11242012 0.75 ESR1 (0.60) RXRARXRBESR1ESR2GRIA4
Hydrochloric Acid SCHEMBL7132954 0.74 ESR1 (0.58) RXRARXRBESR1ESR2GRIA4
SCHEMBL31436580 0.74 ESR1 (0.58) RXRARXRBESR1ESR2GRIA4
Terephthalic Acid SCHEMBL20608374 0.73 TSHR (0.57) ESR1ESR2CDC25BKDM4E

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-11042090-B2 Composition for forming organic film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-06-22 US disclosed
US-20190041752-A1 COMPOSITION FOR FORMING ORGANIC FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-02-07 US disclosed