SCHEMBL9375701

SCHEMBL9375701

Cc1ccn2c(C)c(CCc3ccc4[nH]c(C)nc4c3)nc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
MAPT P10636 3/20 0.33
PARP1 P09874 1/20 0.33
COMT P21964 1/20 0.33
POLB P06746 3/20 0.32
TP53 P04637 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
PSD A5PKW4 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.31

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
SCHEMBL9376180 0.76 TYMS (0.37)
SCHEMBL8934510 0.76 NPC1 (0.41) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
SCHEMBL10651267 0.76 CYP11B1 (0.45) ALDH1A1KDM4ECYP11B1CYP11B2MAPT
Hydrochloric Acid SCHEMBL9376635 0.76 TYMS (0.37) ALDH1A1KDM4EMEN1NPC1RAB9A
SCHEMBL9375099 0.75 TLR8 (0.36) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
SCHEMBL9378049 0.74 MAPT (0.38) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
SCHEMBL9377374 0.74 USP7 (0.41) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
SCHEMBL8934543 0.73 MAOA (0.43) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
Potassium Ion SCHEMBL9376909 0.73 MAPT (0.36) DNMT1ALDH1A1KDM4ECYP11B1CYP11B2
Hydrochloric Acid SCHEMBL9375280 0.73 RAB9A (0.49) ALDH1A1MAPTTP53NPC1RAB9A

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-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
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