SCHEMBL9059944

SCHEMBL9059944

CC1CCN(C(N)=Nc2ccccc2-c2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.48
ACHE P22303 1/20 0.43
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ATM Q13315 2/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRM5 P41594 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
SCHEMBL9059900 0.87 SIGMAR1 (0.49) SIGMAR1ATMSMN1; SMN2RAB9AGAA
SCHEMBL9059465 0.85 SIGMAR1 (0.45) SIGMAR1HPGD
SCHEMBL9060099 0.85 SIGMAR1 (0.47) SIGMAR1
SCHEMBL9059786 0.83 SIGMAR1 (0.46) SIGMAR1KMT2AKDM4E
SCHEMBL9061357 0.82 SIGMAR1 (0.60) SIGMAR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL9059245 0.82 SIGMAR1 (0.44) SIGMAR1ATMSMN1; SMN2MAPK1
SCHEMBL9059800 0.81 CYP46A1 (0.43) SIGMAR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL9059367 0.80 SIGMAR1 (0.46) SIGMAR1ALDH1A1RAB9A
SCHEMBL9311235 0.80 SIGMAR1 (0.46) SIGMAR1ALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL9059998 0.80 SMN1; SMN2 (0.48) SIGMAR1ALDH1A1MEN1KMT2AKDM4E

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