SCHEMBL7423318

SCHEMBL7423318

O=C(O)CCCCCNC(=O)CSc1c(Cl)cccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 1/20 0.46
ATM Q13315 1/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
ITGB3 P05106 2/20 0.44
ITGA2B P08514 2/20 0.44

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
SCHEMBL10389653 0.78 LMNA (0.50) MAPK1SMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL3454803 0.77 ALDH1A1 (0.51) MAPK1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL3115857 0.76 HPGD (0.60) MAPK1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL9265834 0.76 POLB (0.44) SMN1; SMN2KMT2AMEN1LMNAALDH1A1
SCHEMBL5275476 0.75 ALDH1A1 (0.63) MAPK1SMN1; SMN2KMT2ALMNAPRMT1
SCHEMBL4408502 0.73 ALOX5 (0.59) MAPK1LMNAHDAC1HDAC3ALDH1A1
SCHEMBL7396981 0.73 TSHR (0.62) SMN1; SMN2KMT2AMEN1LMNATSHR
SCHEMBL3064663 0.73 FFAR1 (0.54) SMN1; SMN2KMT2AMEN1LMNAALDH1A1
SCHEMBL7420858 0.73 BCHE (0.52) MAPK1SMN1; SMN2KMT2AMEN1HDAC1
SCHEMBL14088967 0.72 POLB (0.69) MAPK1SMN1; SMN2LMNAHDAC1HDAC3

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-6080768-A USEFUL IN THE TREATMENT OF ARTERIAL HYPERTENSION AND HEART FAILURE, RENAL INSUFFICIENCY, PERIPHERAL ARTERIOPATHIES AND CEREBROVASCULAR INSUFFICIENCIES ZAMBON GROUP S.P.A. (IT) 2000-06-27 US disclosed
US-5747513-A HYPOTENSIVE AGENTS, HEART FAILURE AND CEREBROVASCULAR INSUFFICIENCY ZAMBON GROUP, S.P.A. (IT) 1998-05-05 US disclosed
EP-0719252-B1 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON SPA (IT) 1998-02-18 EP disclosed
WO-1995007885-A1 DERIVATIVES OF 2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALENE ACTIVE ON THE CARDIOVASCULAR SYSTEM ZAMBON GROUP S.P.A. (IT) 1995-03-23 WO disclosed