SCHEMBL31334167

SCHEMBL31334167

O=c1ccc(B(O)O)cn1-c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 1/20 0.41
ORAI2 Q96SN7 1/20 0.41
ORAI3 Q9BRQ5 1/20 0.41
TRPV6 Q9H1D0 1/20 0.41
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 2/20 0.36
MGLL Q99685 2/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
BLM P54132 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KCNH2 Q12809 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HCAR1 Q9BXC0 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL10059908 0.74 HRH3 (0.49) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL16474659 0.73 KDM4E (0.41) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL147877 0.73 ALDH1A1 (0.67) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL2466555 0.72 TYR (0.50) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL2459006 0.72 KDM4E (0.51) KDM4ELMNAALDH1A1HPGDMEN1
SCHEMBL142716 0.71 NPC1 (0.46) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL16474401 0.71 HSD17B10 (0.43) KDM4ELMNAALDH1A1CYP1A2HPGD
SCHEMBL2462606 0.70 ALDH1A1 (0.44) KDM4ELMNAALDH1A1MGLLCYP1A2
SCHEMBL21979751 0.70 ORAI1 (0.68) ORAI1ORAI2ORAI3TRPV6KDM4E
SCHEMBL5508 0.70 ORAI1 (0.68) ORAI1ORAI2ORAI3TRPV6KDM4E

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
EP-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed