SCHEMBL9864972

SCHEMBL9864972

CS(=O)(=O)Nc1ccc(C(=O)N2CCCCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.67
RAB9A P51151 1/20 0.67
ALDH1A1 P00352 5/20 0.62
HPGD P15428 3/20 0.62
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HTT P42858 1/20 0.58
PKM P14618 1/20 0.57
CA12 O43570 2/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56
CA14 Q9ULX7 2/20 0.56
LMNA P02545 2/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.55

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
SCHEMBL28086313 0.98 NPC1 (0.64) NPC1RAB9AALDH1A1HPGDMEN1
SCHEMBL10417608 0.92 ADRB2 (0.58) NPC1RAB9AALDH1A1HPGDMEN1
SCHEMBL10645075 0.86 EPHX2 (0.58) NPC1RAB9AHPGDMEN1KMT2A
SCHEMBL8781424 0.85 SIGMAR1 (0.55) NPC1RAB9AALDH1A1HPGDMEN1
Hydrochloric Acid SCHEMBL9838744 0.84 HPGD (0.57) NPC1RAB9AALDH1A1HPGDMEN1
SCHEMBL23775472 0.82 CRHBP (0.51) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL9444390 0.81 MEN1 (0.63) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL10642628 0.80 ADRB2 (0.57) NPC1RAB9AALDH1A1HPGDHTT
Hydrochloric Acid SCHEMBL9444319 0.80 MEN1 (0.62) ALDH1A1MEN1KMT2ALMNAPOLB
SCHEMBL22106122 0.80 HPGD (0.71) NPC1RAB9AALDH1A1HPGDMEN1

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-4996215-A Antiarrythmia agents EISAI CO., LTD. (JP) 1991-02-26 US disclosed