SCHEMBL9816263

SCHEMBL9816263

O=C1CCCCCCCCCCCCCC1Br

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.52
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA4 P22748 3/20 0.48
CA6 P23280 2/20 0.39
TRIM24 O15164 2/20 0.36
TRIM33 Q9UPN9 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MCL1 Q07820 1/20 0.35
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
TLR4 O00206 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
MT-CO2 P00403 1/20 0.32
ALOX5 P09917 1/20 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
SCHEMBL11230938 1.00 KMT2A (0.52) KMT2ACA1CA2CA4CA6
SCHEMBL2948875 1.00 KMT2A (0.52) KMT2ACA1CA2CA4CA6
SCHEMBL6627461 1.00
SCHEMBL7530097 1.00 KMT2A (0.52) KMT2ACA1CA2CA4CA6
SCHEMBL21495046 0.97
SCHEMBL918055 0.97
Ethylene SCHEMBL7388735 0.95 KMT2A (0.48) KMT2ACA1CA2CA4CA6
SCHEMBL2342739 0.89
SCHEMBL13125935 0.75 KMT2A (0.46) KMT2ACA1CA2CA4CA6
SCHEMBL1551749 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4861917-A Process for preparing macrocyclic 2-halogenoketones SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-08-29 US claimed
WO-2025035202-A1 IONIZABLE LIPIDS COMPRISING MACROCYCLIC RINGS FOR THE DELIVERY OF THERAPEUTIC AGENTS NANOVATION THERAPEUTICS INC. (CA) 2025-02-20 WO disclosed
EP-0290015-B1 PROCESS FOR PREPARING MACROCYCLIC 2-HALOGENOKETONES SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-16 EP disclosed
US-4861917-A Process for preparing macrocyclic 2-halogenoketones SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-08-29 US disclosed
EP-0290015-A1 Process for preparing macrocyclic 2-Halogenoketones SAGAMI CHEMICAL RESEARCH CENTER (JP) 1988-11-09 EP disclosed