SCHEMBL7240144

SCHEMBL7240144

Cc1c(Br)ccc(S(C)(=O)=O)c1C1=NOC(CBr)C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MIF P14174 6/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL7233095 0.84 NPC1 (0.35) NPC1RAB9A
SCHEMBL701268 0.73 EDNRB (0.30)
SCHEMBL6677226 0.72 NPC1 (0.37) NPC1RAB9AMIFHDAC6
Bromide SCHEMBL28689439 0.72
SCHEMBL14355306 0.70
SCHEMBL7232618 0.70
SCHEMBL7242122 0.69 NPC1 (0.38) NPC1RAB9AMIFALDH1A1
SCHEMBL29021557 0.68
SCHEMBL27583463 0.68 NPC1 (0.33) NPC1RAB9A
SCHEMBL5836830 0.67 EPAS1 (0.32)

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
US-6613719-B1 Agricultural herbicides; acylation BASF AKTIENGESELLSCHAFT (DE) 2003-09-02 US disclosed