SCHEMBL11056083

SCHEMBL11056083

Cc1cc(Cl)ccc1NC(=O)NC(=N)N

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.51
NOX1 Q9Y5S8 1/20 0.50
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 2/20 0.49
NPSR1 Q6W5P4 1/20 0.48
IDH1 O75874 1/20 0.48
GAA P10253 2/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 3/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
CASP3 P42574 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
LMNA P02545 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GLA P06280 1/20 0.43

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
SCHEMBL11278586 0.88 LMNA (0.57) SMN1; SMN2NPSR1GAAMEN1KMT2A
SCHEMBL11420450 0.84 NOX1 (0.53) MAPK1NOX1RAB9ASMN1; SMN2NPC1
SCHEMBL11052921 0.84 MEN1 (0.56) MAPK1RAB9ASMN1; SMN2NPC1NPSR1
SCHEMBL11141794 0.84 PYGL (0.53) RAB9ASMN1; SMN2NPC1MEN1KMT2A
SCHEMBL10592729 0.84 NOX1 (0.59) MAPK1NOX1RAB9ASMN1; SMN2NPC1
SCHEMBL11055522 0.82 ALDH1A1 (0.41) RAB9ASMN1; SMN2NPSR1GAAMEN1
SCHEMBL11270280 0.82 CHIT1 (0.48) RAB9ASMN1; SMN2NPC1NPSR1MEN1
SCHEMBL11420561 0.82 CA12 (0.54) RAB9ASMN1; SMN2NPC1NPSR1MEN1
SCHEMBL11136359 0.82 NOX1 (0.67) NOX1RAB9ASMN1; SMN2NPC1GAA
SCHEMBL11266958 0.82 MAPK1 (0.51) MAPK1NOX1RAB9ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0073276-A1 A method of increasing the feed efficiency of animals, and compositions for use in such a method RORER INTERNATIONAL (OVERSEAS) INC. (US) 1983-03-09 EP claimed
US-4150154-A GASTROINTESTINAL ANTISPASMODICS WILLIAM H. RORER, INC. (US) 1979-04-17 US claimed
US-4452980-A DIARRHEA WILLIAM H. RORER, INC. (US) 1984-06-05 US disclosed
US-4326075-A ANTIDIARRHEA AGENTS WILLIAM H. RORER, INC. (US) 1982-04-20 US disclosed
US-4246409-A ANTIDIARRHEAL AGENTS WILLIAM H. RORER, INC. (US) 1981-01-20 US disclosed
US-4225315-A Triazinones from amidinoureas WILLIAM H. RORER, INC. (US) 1980-09-30 US disclosed
US-4216229-A 1-AMIDINO-3-PHENYLUREAS WILLIAM H. RORER, INC. (US) 1980-08-05 US disclosed
US-4216230-A Method for alleviating hypertension with amidinoureas WILLIAM H. RORER, INC. (US) 1980-08-05 US disclosed
US-4203920-A ANTIDIARRHEAL WILLIAM H. RORER, INC. (US) 1980-05-20 US disclosed
US-4150154-A GASTROINTESTINAL ANTISPASMODICS WILLIAM H. RORER, INC. (US) 1979-04-17 US disclosed
US-4060635-A Amidinoureas for treating diarrhea WILLIAM H. RORER, INC. (US) 1977-11-29 US disclosed