SCHEMBL26862706

SCHEMBL26862706

C=C(C)C(=O)OCC(=O)OC(c1ccc(O)cc1)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.36
▸ ESR2 Q92731 5/20 0.36
▸ TSHR P16473 1/20 0.33
▸ TYR P14679 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ ADRB2 P07550 1/20 0.30
▸ ADRB1 P08588 1/20 0.30
▸ ADRB3 P13945 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ APEX1 P27695 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ DEGS1 O15121 1/20 0.30

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
SCHEMBL24908561 0.85 ESR1 (0.43) ESR1ESR2TDP1DEGS1
SCHEMBL18372593 0.84 ESR1 (0.40) ESR1ESR2TSHRTYRPOLB
SCHEMBL26861539 0.81 TSHR (0.40) ESR1ESR2TSHRTYR
SCHEMBL26862766 0.80 HSD17B1 (0.33) —
SCHEMBL25765230 0.76 ESR1 (0.46) ESR1ESR2TDP1DEGS1
SCHEMBL26816175 0.74 ALDH1A1 (0.40) TSHR
SCHEMBL2611541 0.74 TSHR (0.43) TSHR
SCHEMBL26871208 0.74 ESR1 (0.33) ESR1ESR2
SCHEMBL26861522 0.73 ESR1 (0.33) ESR1ESR2
SCHEMBL2608065 0.73 TSHR (0.46) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230375925-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, PATTERN FORMING METHOD, METHOD FOR MANUFACTURING ELECTRONIC DEVICE, COMPOUND, AND RESIN FUJIFILM CORPORATION (JP) 2023-11-23 — — US disclosed
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