SCHEMBL9423911

SCHEMBL9423911

CCCCC/C(=N/c1ccccc1N1CCOCC1)NC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
NPSR1 Q6W5P4 3/20 0.43
LMNA P02545 4/20 0.42
KMT2A Q03164 5/20 0.41
PLA2G1B P04054 1/20 0.41
TSHR P16473 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 4/20 0.39
MAPT P10636 3/20 0.39
CNR1 P21554 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
KCNQ2 O43526 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
RAB9A P51151 1/20 0.38
CYP3A4 P08684 2/20 0.37
CYP2C19 P33261 2/20 0.37
TP53 P04637 1/20 0.37
CYP2D6 P10635 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
SCHEMBL9423913 1.00 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1LMNAKMT2APLA2G1B
SCHEMBL9059067 0.96 SMN1; SMN2 (0.50) SMN1; SMN2NPSR1LMNAKMT2APLA2G1B
SCHEMBL9059065 0.96 SMN1; SMN2 (0.50) SMN1; SMN2NPSR1LMNAKMT2APLA2G1B
SCHEMBL9424269 0.91 LMNA (0.46) SMN1; SMN2NPSR1LMNAKMT2AALDH1A1
SCHEMBL9424270 0.91 LMNA (0.46) SMN1; SMN2NPSR1LMNAKMT2AALDH1A1
SCHEMBL9059307 0.89 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1LMNAKMT2APLA2G1B
SCHEMBL9059309 0.89 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1LMNAKMT2APLA2G1B
SCHEMBL9424743 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPSR1LMNAKMT2ATSHR
SCHEMBL9424747 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPSR1LMNAKMT2ATSHR
SCHEMBL9424111 0.81 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1LMNAKMT2ATSHR

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