SCHEMBL23753333

SCHEMBL23753333

O=C(O)c1cc(C(F)(F)F)c(C(=O)O)cc1Br

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASPH Q12797 1/20 0.49
TAS2R14 Q9NYV8 4/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA3 P07451 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA13 Q8N1Q1 1/20 0.43
CA14 Q9ULX7 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CES2 O00748 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
SCHEMBL3036944 0.87 ASPH (0.59) ASPHTAS2R14HSD17B10CES2AKR1C3
SCHEMBL29077087 0.86 TAS2R14 (0.49) ASPHTAS2R14HSD17B10EPRS1AKR1C4
SCHEMBL30748715 0.85 ASPH (0.57) ASPHTAS2R14HSD17B10CES2AKR1C3
SCHEMBL30777934 0.85 ASPH (0.57) ASPHTAS2R14HSD17B10CES2AKR1C3
Hydrochloric Acid SCHEMBL22164128 0.85 ASPH (0.57) ASPHTAS2R14HSD17B10CES2AKR1C3
SCHEMBL21487711 0.85 ASPH (0.46) ASPHTAS2R14CA12CA1CA2
SCHEMBL31430665 0.83 ASPH (0.45) ASPHTAS2R14LCKFYNSMN1; SMN2
SCHEMBL23753287 0.83 ASPH (0.45) ASPHTAS2R14LCKFYNSMN1; SMN2
SCHEMBL4860299 0.83 ASPH (0.55) ASPHTAS2R14HSD17B10CES2NOTUM
SCHEMBL26931212 0.81 TAS2R14 (0.42) ASPHTAS2R14LCKFYNCA12

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
US-12253526-B2 Fluorescent dye and use thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2025-03-18 US disclosed
US-20210255191-A1 FLUORESCENT DYE AND USE THEREOF EISAI R&D MANAGEMENT CO., LTD. (JP) 2021-08-19 US disclosed
CN-113214305-A Fluorescent dye and use thereof 卫材R&D管理有限公司 2021-08-06 CN disclosed