SCHEMBL9059577

SCHEMBL9059577

Cc1cccc(-c2ccccc2NC(=N)N(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LMNA P02545 1/20 0.45
PLA2G1B P04054 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45
CHRM3 P20309 7/20 0.45
FABP4 P15090 1/20 0.37
CNR2 P34972 2/20 0.37
CNR1 P21554 1/20 0.37
ADORA1 P30542 1/20 0.37

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
SCHEMBL9311252 0.84 FABP4 (0.49) ALDH1A1MEN1KMT2AFABP4
SCHEMBL9062891 0.84 POLB (0.47) CHRM3FABP4
SCHEMBL9059653 0.83 ALDH1A1 (0.49) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9311515 0.82 MAPT (0.38) ALDH1A1L3MBTL1MEN1KMT2AFABP4
SCHEMBL9313055 0.80 ALDH1A1 (0.42) ALDH1A1L3MBTL1LMNA
SCHEMBL11171346 0.79 CHRM3 (0.46) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL3913935 0.78 L3MBTL1 (0.59) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL6719733 0.77 KMT2A (0.47) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL9059754 0.76 FABP4 (0.49) ALDH1A1LMNAFABP4
SCHEMBL9059324 0.76 TDP1 (0.46) ALDH1A1L3MBTL1LMNAPLA2G1BATG4B

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
WO-1996017612-A1 USE OF SUBSTITUTED PHENYLAMIDINE AND PHENYLGUANIDINE COMPOUNDS FOR THE TREATMENT OF CEREBRAL AND CARDIAC ISCHAEMIA, CONVULSION AND SICKLE CELL ANAEMIA KNOLL AKTIENGESELLSCHAFT (DE) 1996-06-13 WO disclosed
EP-0536151-B1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM BOOTS CO PLC (GB) 1994-09-14 EP disclosed
US-5302720-A Biphenyl-substituted guanidine derivatives useful as hypoglycaemic agents THE BOOTS COMPANY (GB) 1994-04-12 US disclosed
EP-0536151-A1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM. BOOTS CO PLC (GB) 1993-04-14 EP disclosed
WO-1992000273-A1 ORTHOSUBSTITUTED BIPHENYL AMIDINE AND BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM THE BOOTS COMPANY PLC (GB) 1992-01-09 WO disclosed