SCHEMBL29093545

SCHEMBL29093545

Fc1ccc2cc3c(F)c(F)c(F)c(F)c3cc2c1F

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.33
ESR2 Q92731 5/20 0.33
ALDH1A1 P00352 1/20 0.32
HIF1A Q16665 1/20 0.32
CYP1B1 Q16678 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
HPRT1 P00492 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
SCHEMBL12278340 0.80 ALDH1A1 (0.40) ESR1ESR2ALDH1A1HIF1ACYP1B1
SCHEMBL7114201 0.80
SCHEMBL6838128 0.79 ALDH1A1 (0.46) ALDH1A1HIF1ACYP1B1HSD17B10CA9
SCHEMBL1312172 0.77 ALDH1A1 (0.44) ALDH1A1HIF1ACYP1B1HSD17B10HPRT1
SCHEMBL2709997 0.76 CYP1A2 (0.37) ESR1ESR2ALDH1A1HIF1ACYP1B1
SCHEMBL27586130 0.75
SCHEMBL2710690 0.74 HSD17B1 (0.39) ALDH1A1HIF1ACYP1B1HSD17B10CA9
SCHEMBL8591811 0.73 CA3 (0.42) ALDH1A1CA3CA6CA5ACA9
SCHEMBL29464018 0.72 CA12 (0.30)
SCHEMBL2709864 0.72 CA12 (0.30)

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
CN-110325911-B Photosensitive resin composition, heterocyclic ring-containing polymer precursor, cured film, laminate, method for producing cured film, and semiconductor device 富士胶片株式会社 2023-01-06 CN disclosed