SCHEMBL8169583

SCHEMBL8169583

O=CNc1nc2cc(Cl)ccc2o1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
MAPT P10636 1/20 0.56
THRB P10828 1/20 0.56
ALOX15 P16050 1/20 0.56
MAPK1 P28482 1/20 0.56
FBP1 P09467 13/20 0.55
KCNH2 Q12809 2/20 0.53
MEN1 O00255 1/20 0.53
GAA P10253 1/20 0.53
KMT2A Q03164 1/20 0.53
FFAR2 O15552 1/20 0.52
PSMB8 P28062 1/20 0.51

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
SCHEMBL18727424 0.81 HDAC6 (0.38) MAPTFBP1KCNH2MEN1GAA
SCHEMBL21154027 0.78 LMNA (0.56) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL10700728 0.78 LMNA (0.56) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL8169578 0.77 FBP1 (0.55) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL3777315 0.76 KCNH2 (0.63) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL6591400 0.76 NPC1 (0.56) LMNAMAPTALOX15MEN1GAA
SCHEMBL14047971 0.75 FFAR2 (0.60) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL7464328 0.75 KDM4E (0.64) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL21162595 0.74 FBP1 (0.55) LMNACYP1A2MAPTTHRBALOX15
SCHEMBL19899736 0.74 NPC1 (0.60) LMNACYP1A2MAPTTHRBALOX15

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-6110933-A AN ENZYME INHIBITOR TREATING PANCREATITIS, HEPATITIS, CHRONIC RENAL FAILURE, ENDOTOXIN SHOCK, GRAM-NEGATIVE SEPTIC SHOCK, ARTHRITIS, RESPIRATORY DISEASE, HEART DISEASE, ALLERGIC DISEASE, THROMBOSIS, ARTERIOSCLEROSIS, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-29 US disclosed
EP-0741697-B1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 1999-09-15 EP disclosed
EP-0741697-A1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-13 EP disclosed
WO-1995019959-A1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-07-27 WO disclosed