SCHEMBL9375356

SCHEMBL9375356

CNc1nc2ccc(Cc3ccccn3)cc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.47
MAPT P10636 6/20 0.47
NPC1 O15118 5/20 0.47
OPRK1 P41145 3/20 0.47
HTT P42858 3/20 0.47
S1PR1 P21453 1/20 0.45
LDHA P00338 1/20 0.44
PKM P14618 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 2/20 0.42
AGTR1 P30556 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
PIK3CA P42336 1/20 0.40
AURKB Q96GD4 2/20 0.40

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
SCHEMBL9382411 0.90 MAPT (0.46) RAB9AMAPTNPC1OPRK1HTT
SCHEMBL9375013 0.82 ABL1 (0.62) RAB9AMAPTNPC1OPRK1HTT
SCHEMBL9375983 0.81 RAB9A (0.62) RAB9AMAPTNPC1HTTS1PR1
SCHEMBL9381221 0.78 NOS3 (0.47) RAB9AMAPTNPC1OPRK1HTT
SCHEMBL13766289 0.77 SMN1; SMN2 (0.61) RAB9AMAPTNPC1HTTLDHA
SCHEMBL9379688 0.76 RAB9A (0.56) RAB9AMAPTNPC1LDHASMN1; SMN2
SCHEMBL23965796 0.75 NPC1 (0.58) RAB9AMAPTNPC1OPRK1HTT
SCHEMBL9377356 0.75 RAB9A (0.41) RAB9AMAPTNPC1OPRK1HTT
SCHEMBL28204620 0.73 L3MBTL1 (0.50) S1PR1L3MBTL1CYP1A2CYP2D6
SCHEMBL9381341 0.73 RAB9A (0.55) RAB9AMAPTNPC1LDHASMN1; SMN2

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
JP-2104578-A None JP disclosed
EP-0356234-B1 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-05-11 EP disclosed
US-5047411-A Antiulcer Agents, H2-Receptor Antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
JP-H02104578-A BENZAZOLE DERIVATIVE, PRODUCTION THEREOF AND MEDICINE COMPOSITION CONTAINING THE SAME FUJISAWA PHARMACEUT CO LTD 1990-04-17 JP disclosed
EP-0356234-A2 New Benzazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 EP disclosed