SCHEMBL9424167

SCHEMBL9424167

CSc1ccc(N2CCOCC2)c(/N=C(\N)N(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
SCN1A P35498 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN3A Q9NY46 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 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
SCHEMBL9424169 1.00 GRIN2D (0.43) GRIN2DGRIN3BSCN1AGRIN1GRIN2A
SCHEMBL9423979 0.84 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9423977 0.84 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
Hydrochloric Acid SCHEMBL9424435 0.82 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
Hydrochloric Acid SCHEMBL9424436 0.82 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9424392 0.82 AKR1C3 (0.46) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9424300 0.82 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9424297 0.82 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9424397 0.82 AKR1C3 (0.46) SMN1; SMN2ALDH1A1MAPTMEN1LMNA
SCHEMBL9059748 0.82 GAA (0.36) SMN1; SMN2ALDH1A1MAPTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
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