SCHEMBL22389088

SCHEMBL22389088

C=C(C)C(=O)OCCOCCOCCOc1ccccc1-c1cccc(COC(=O)C(=C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.46
▸ KDM4E B2RXH2 6/20 0.45
▸ FFAR1 O14842 2/20 0.44
▸ PTGER1 P34995 6/20 0.44
▸ PTGER4 P35408 5/20 0.44
▸ PTGER3 P43115 5/20 0.44
▸ PTGER2 P43116 5/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ USP2 O75604 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ LMNA P02545 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
SCHEMBL25123525 0.86 ALDH1A1 (0.60) ALDH1A1KDM4ESMN1; SMN2USP2MEN1
SCHEMBL25796435 0.86 ALDH1A1 (0.60) ALDH1A1KDM4ESMN1; SMN2USP2MEN1
SCHEMBL7524394 0.82 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2USP2MEN1
SCHEMBL29550232 0.82 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2USP2MEN1
SCHEMBL17036775 0.80 THRB (0.44) KDM4EFFAR1TDP1LMNA
SCHEMBL17033943 0.79 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2KMT2AADRB2
SCHEMBL1938350 0.79 THRB (0.46) ALDH1A1KDM4ESMN1; SMN2USP2MEN1
SCHEMBL31256680 0.79 THRB (0.45) ALDH1A1KDM4EFFAR1PTGER1PTGER4
SCHEMBL25119633 0.79 ALDH1A1 (0.52) ALDH1A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL25123541 0.78 KDM4E (0.53) ALDH1A1KDM4ESMN1; SMN2USP2MEN1

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-11135422-B2 Bio-electrode and methods for manufacturing the bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-10-05 — — US disclosed
US-20200276437-A1 BIO-ELECTRODE AND METHODS FOR MANUFACTURING THE BIO-ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-09-03 — — US disclosed
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