SCHEMBL9424739

SCHEMBL9424739

CCN(C)/C(=N/c1ccccc1N1CCOCC1)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
RECQL P46063 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
KCNQ2 O43526 1/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 4/20 0.36
KDM4E B2RXH2 1/20 0.36
AKR1C3 P42330 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
POLB P06746 2/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL9424742 1.00 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9060399 0.89 ALOX15 (0.41) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9060069 0.88 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9060073 0.88 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
Iodide SCHEMBL9424454 0.88 ALOX15 (0.40) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9059292 0.87 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9059295 0.87 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9059176 0.85 ALOX15 (0.36) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9059175 0.85 ALOX15 (0.36) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A
SCHEMBL9424227 0.85 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1RECQLL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5373008-A Phenylamidine and phenylguanidine derivatives and their use as anti-diabetic agents THE BOOTS COMPANT PLC. (GB) 1994-12-13 US disclosed
US-5223498-A Hypoglycemic agents THE BOOTS COMPANY PLC (GB) 1993-06-29 US disclosed
EP-0385038-B1 ORTHO-SUBSTITUTED PHENYL AMIDINE AND PHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM The Boots Company PLC (GB) 1993-06-02 EP disclosed
EP-0385038-A1 Ortho-substituted phenyl amidine and phenyl guanidine derivatives and antidiabetic or hypoglycaemic agents containing them The Boots Company PLC (GB) 1990-09-05 EP disclosed