SCHEMBL8974700

SCHEMBL8974700

Cc1nc(-c2csc(NC(=N)NCc3ccccc3)n2)c[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 4/20 0.47
ROCK2 O75116 3/20 0.47
ATP4A P20648 8/20 0.44
ATP4B P51164 8/20 0.44
ALDH1A1 P00352 5/20 0.43
LMNA P02545 3/20 0.43
HPGD P15428 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RAB9A P51151 2/20 0.41
ELOVL1 Q9BW60 1/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
GAA P10253 3/20 0.40
KMT2A Q03164 3/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 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
Hydrochloric Acid SCHEMBL10454848 0.99 ROCK1 (0.46) ROCK1ROCK2ATP4AATP4BALDH1A1
SCHEMBL10878215 0.91 ALDH1A1 (0.42) ROCK1ROCK2ATP4AATP4BALDH1A1
SCHEMBL10591610 0.85 MEN1 (0.44) ALDH1A1LMNAHPGDNPSR1HTT
SCHEMBL9789065 0.83 ATP4A (0.63) ROCK1ROCK2ATP4AATP4BALDH1A1
SCHEMBL10591522 0.83 ROCK2 (0.50) ROCK1ROCK2ALDH1A1LMNAHPGD
SCHEMBL9788980 0.81 ATP4A (0.63) ROCK1ROCK2ATP4AATP4BALDH1A1
SCHEMBL9789001 0.80 ATP4A (0.61) ROCK1ROCK2ATP4AATP4BRAB9A
SCHEMBL9632287 0.80 MAPT (0.39) ATP4AATP4BALDH1A1LMNAHPGD
SCHEMBL9789069 0.79 ATP4A (0.65) ROCK1ATP4AATP4BALDH1A1LMNA
SCHEMBL7398067 0.79 ATP4A (0.42) ATP4AATP4BALDH1A1LMNAHPGD

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0703782-A1 H2-ANTAGONISTS AS IMMUNE STIMULANTS IN BACTERIAL INFECTIONS OF CATTLE OR SWINE PFIZER INC. (US) 1996-04-03 EP claimed
WO-1994028898-A1 H2-ANTAGONISTS AS IMMUNE STIMULANTS IN BACTERIAL INFECTIONS OF CATTLE OR SWINE PFIZER INC. (US) 1994-12-22 WO claimed
EP-0178121-B1 IMPROVED FORMULATION OF ANTIINFLAMMATORY DRUGS PFIZER INC. (US) 1990-06-13 EP claimed
EP-0161841-B1 2-(N-SUBSTITUTEGUANIDINO)-4-HETERO-ARYLTHIAZOLE ANTIULCER AGENTS PFIZER INC. (US) 1989-07-19 EP claimed
US-4636498-A OXICAMS, ANTIULCER, ANTISECRETORY 2-GUANIDINO-4-(4-IMIDAZOLYL) THIAZOLES PFIZER INC. (US) 1987-01-13 US claimed
EP-0178121-A2 Improved formulation of antiinflammatory drugs PFIZER INC. (US) 1986-04-16 EP claimed
US-4560690-A ANTISECRETORY AGENTS, HISTAMINE H2-ANTAGONISTS PFIZER INC. (US) 1985-12-24 US claimed
EP-0161841-A1 2-(N-substituteguanidino)-4-hetero-arylthiazole antiulcer agents PFIZER INC. (US) 1985-11-21 EP claimed
EP-0703782-A1 H2-ANTAGONISTS AS IMMUNE STIMULANTS IN BACTERIAL INFECTIONS OF CATTLE OR SWINE PFIZER INC. (US) 1996-04-03 EP disclosed
WO-1994028898-A1 H2-ANTAGONISTS AS IMMUNE STIMULANTS IN BACTERIAL INFECTIONS OF CATTLE OR SWINE PFIZER INC. (US) 1994-12-22 WO disclosed
US-4997949-A Antiulcer PFIZER INC. (US) 1991-03-05 US disclosed
US-4997981-A Alkylation PFIZER INC. (US) 1991-03-05 US disclosed
EP-0178121-B1 IMPROVED FORMULATION OF ANTIINFLAMMATORY DRUGS PFIZER INC. (US) 1990-06-13 EP disclosed
EP-0161841-B1 2-(N-SUBSTITUTEGUANIDINO)-4-HETERO-ARYLTHIAZOLE ANTIULCER AGENTS PFIZER INC. (US) 1989-07-19 EP disclosed
WO-1988003140-A1 CRYSTALLINE 2-(1-PENTYL-3-GUANIDINO)-4-(2-METHYL-4-IMIDAZOLYL)THIAZOLE DIHYDROCHLORIDE TRIHYDRATE PFIZER INC. (US) 1988-05-05 WO disclosed
US-4636498-A OXICAMS, ANTIULCER, ANTISECRETORY 2-GUANIDINO-4-(4-IMIDAZOLYL) THIAZOLES PFIZER INC. (US) 1987-01-13 US disclosed
US-4636498-A OXICAMS, ANTIULCER, ANTISECRETORY 2-GUANIDINO-4-(4-IMIDAZOLYL) THIAZOLES PFIZER INC. (US) 1987-01-13 US disclosed
EP-0178121-A2 Improved formulation of antiinflammatory drugs PFIZER INC. (US) 1986-04-16 EP disclosed
EP-0178121-A2 Improved formulation of antiinflammatory drugs PFIZER INC. (US) 1986-04-16 EP disclosed
US-4560690-A ANTISECRETORY AGENTS, HISTAMINE H2-ANTAGONISTS PFIZER INC. (US) 1985-12-24 US disclosed