SCHEMBL7747808

SCHEMBL7747808

O=C(O)/C=C/c1ccc(NC(=O)Nc2cccnc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.64
NPC1 O15118 9/20 0.64
MEN1 O00255 6/20 0.61
KMT2A Q03164 6/20 0.61
ALDH1A1 P00352 3/20 0.61
KDM4E B2RXH2 2/20 0.61
TBXAS1 P24557 2/20 0.56
MAPT P10636 3/20 0.55
POLB P06746 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PKM P14618 2/20 0.55
NAMPT P43490 1/20 0.52
LMNA P02545 1/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52

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
SCHEMBL7747810 1.00 RAB9A (0.64) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL8195098 0.85 HDAC1 (0.62) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL8195099 0.85 HDAC1 (0.62) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL10665495 0.82 RAB9A (0.79) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL7747208 0.81 RAB9A (0.61) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL7747209 0.81 RAB9A (0.61) RAB9ANPC1MEN1KMT2AKDM4E
SCHEMBL9637653 0.80 MEN1 (0.77) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL30051982 0.80 MEN1 (0.77) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL21593633 0.78 RAB9A (1.00) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL16180694 0.78 RAB9A (1.00) RAB9ANPC1MEN1KMT2AALDH1A1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0622361-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2001-10-04 EP disclosed
US-6169095-B1 FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES IN THE EYE, SUCH AS ALLERGY, INFLAMMATION AND PAIN OF THE EYE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
US-5563162-A CAN BE ADMINISTERD FOR THE TREATMENT OF ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASES, SHOCK OR PAIN IN ANIMALS AND HUMANS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-08 US disclosed
EP-0622361-A1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-02 EP disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed