SCHEMBL6982146

SCHEMBL6982146

N#CNC(=S)Nc1ccc(Cl)cc1.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 2/20 0.56
GAA P10253 1/20 0.56
NOX1 Q9Y5S8 1/20 0.53
EPHX1 P07099 2/20 0.50
CNR1 P21554 1/20 0.50
NPSR1 Q6W5P4 3/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
NLRP3 Q96P20 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CYP19A1 P11511 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL2973297 0.98 MAPT (0.58) MAPTKDM4EALDH1A1GAANOX1
SCHEMBL5404673 0.89 ALDH1A1 (0.53) MAPTKDM4EALDH1A1GAANOX1
SCHEMBL6977163 0.81 KMT2A (0.55) MAPTALDH1A1GAANPSR1SMN1; SMN2
SCHEMBL5445907 0.80 MAPT (0.75) MAPTKDM4EALDH1A1GAANOX1
SCHEMBL8956455 0.80 MAPT (0.75) MAPTKDM4EALDH1A1GAANOX1
SCHEMBL8983416 0.79 GAA (0.58) MAPTKDM4EALDH1A1GAANOX1
SCHEMBL7639228 0.79 IDO1 (0.68) MAPTKDM4EALDH1A1GAALMNA
SCHEMBL8987945 0.79 KMT2A (0.56) MAPTALDH1A1GAANPSR1SMN1; SMN2
SCHEMBL4037799 0.79 IDO1 (0.62) MAPTALDH1A1GAAEPHX1NPSR1
SCHEMBL4000388 0.79 ALDH1A1 (0.64) MAPTKDM4EALDH1A1GAANOX1

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
EP-1228058-B1 BENZOPYRANYL GUANIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DONGBU HANNONG CHEMICAL CO LTD (KR) 2003-12-10 EP disclosed
EP-1228058-A4 BENZOPYRANYL GUANIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DONGBU HANNONG CHEMICAL CO LTD (KR) 2003-02-12 EP disclosed
EP-1228058-A1 BENZOPYRANYL GUANIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dongbu Hannong Chemical Co., Ltd. (KR) 2002-08-07 EP disclosed
US-6323238-B1 CARDIOVASCULAR DISORDERS, NERVOUS SYSTEM DISORDERS DONGBU HANNONG CHEMICAL CO., LTD. (KR) 2001-11-27 US disclosed
WO-2001029023-A1 BENZOPYRANYL GUANIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2001-04-26 WO disclosed