SCHEMBL31753632

SCHEMBL31753632

Oc1cc(F)c(Br)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA3 P07451 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
KDM1A O60341 4/20 0.39
KCNH2 Q12809 2/20 0.39
KDM1B Q8NB78 2/20 0.39
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
ALOX15 P16050 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
CYP3A4 P08684 2/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
AKR1B1 P15121 1/20 0.33
HSD17B1 P14061 2/20 0.32
HSD17B2 P37059 2/20 0.32

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
SCHEMBL366414 1.00 CA3 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL30221962 0.89 CA3 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL2916768 0.89 CA3 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL30687171 0.86 ALOX15 (0.38) CA3CA6CA5ACA9CA14
SCHEMBL1697562 0.86 ALOX15 (0.38) CA3CA6CA5ACA9CA14
SCHEMBL29547583 0.83 ALOX15 (0.40) CA3CA6CA5ACA9CA14
SCHEMBL505780 0.82 KDM1A (0.48) CA9KDM1AKCNH2KDM1BNPC1
SCHEMBL5513421 0.82 CA9 (0.53) CA3CA6CA5ACA9CA14
SCHEMBL1266166 0.80 ALOX15 (0.42) CA3CA6CA5ACA9CA14
SCHEMBL396273 0.77 MAPT (0.37) CA3CA6CA5ACA9CA14

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
WO-2025262297-A1 PROTAC DEGRADERS OF MLLT1 AND/OR MLLT3 DARK BLUE THERAPEUTICS LTD (GB) 2025-12-26 WO disclosed