SCHEMBL10467765

SCHEMBL10467765

O=S(=O)(Nc1ccccn1)c1nc2ccccc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
HPGD P15428 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
ALOX15 P16050 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 5/20 0.49
LMNA P02545 3/20 0.49
MAPK1 P28482 2/20 0.48
HSD17B10 Q99714 2/20 0.48
BRD4 O60885 1/20 0.47
POLB P06746 1/20 0.47
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.45
MTOR P42345 1/20 0.45
METAP2 P50579 1/20 0.45
METAP1 P53582 1/20 0.45

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
SCHEMBL30925465 0.79 SLC40A1 (0.62) ALDH1A1MEN1KMT2AALOX15LMNA
SCHEMBL6738508 0.79 STK33 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL27214319 0.79 SLC40A1 (0.62) ALDH1A1MEN1KMT2AALOX15LMNA
SCHEMBL477759 0.78 L3MBTL1 (0.53) ALDH1A1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL10466099 0.77 MAPK1 (0.52) ALDH1A1MEN1KMT2AHPGDL3MBTL1
SCHEMBL10466047 0.76 L3MBTL1 (0.67) ALDH1A1SMN1; SMN2MEN1KMT2ANPC1
SCHEMBL8229545 0.76 L3MBTL1 (0.67) ALDH1A1SMN1; SMN2MEN1KMT2ANPC1
SCHEMBL5330672 0.76 L3MBTL1 (0.57) ALDH1A1MEN1KMT2AL3MBTL1TSHR
SCHEMBL10464928 0.75 NPSR1 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL28577702 0.75 CA2 (0.50) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0246126-A1 Benzimidazoles and imidazopyridine sulfone amides, process for their preparation and their use as medicaments LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1987-11-19 EP claimed
US-4943570-A GASTROINTESTINAL DISORDERS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1990-07-24 US disclosed
US-4933338-A ANTIULCER AGENTS, ANTISECRETORY AGENTS, TREATMENT OF GASTROINTESTINAL DISORDERS; CHEMICAL INTERMEDIATES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 1990-06-12 US disclosed