SCHEMBL9424604

SCHEMBL9424604

C/C(=N\c1ccccc1N1CCOCC1)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
AKR1C3 P42330 3/20 0.40
MAPT P10636 3/20 0.39
POLB P06746 3/20 0.39
ALDH1A1 P00352 5/20 0.39
RECQL P46063 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MITF O75030 1/20 0.39
PTBP1 P26599 1/20 0.39
HTT P42858 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL9424607 1.00 ALOX15 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL9060399 0.87 ALOX15 (0.41) ALOX15HSD17B10AKR1C3MAPTPOLB
Iodide SCHEMBL9424454 0.85 ALOX15 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL9424203 0.85 SMN1; SMN2 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL9424206 0.85 SMN1; SMN2 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL6553147 0.84 SIGMAR1 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL2707104 0.84 SIGMAR1 (0.40) ALOX15HSD17B10AKR1C3MAPTPOLB
Hydrochloric Acid SCHEMBL9424101 0.83 SIGMAR1 (0.39) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL9060301 0.83 AKR1C3 (0.44) ALOX15HSD17B10AKR1C3MAPTPOLB
SCHEMBL9060311 0.83 AKR1C3 (0.44) ALOX15HSD17B10AKR1C3MAPTPOLB

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