SCHEMBL7659330

SCHEMBL7659330

COC(=O)/C([C]=O)=C/c1ccccn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
MAPT P10636 5/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
KMT2A Q03164 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
ALDH1A1 P00352 2/20 0.45
RAB9A P51151 7/20 0.44
NPC1 O15118 6/20 0.44
MEN1 O00255 2/20 0.40
ATM Q13315 1/20 0.40
HTT P42858 1/20 0.39
SLC16A1 P53985 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 2/20 0.38
TUBB4A P04350 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38
TUBA1B P68363 1/20 0.38
TUBA4A P68366 1/20 0.38
TUBB4B P68371 1/20 0.38

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
SCHEMBL7659335 1.00 KDM4E (0.45) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7666678 0.84 MAPT (0.48) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7666675 0.84 MAPT (0.48) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7977373 0.83 TDP1 (0.46) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7977371 0.83 TDP1 (0.46) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL6642021 0.82 L3MBTL1 (0.54) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL6642016 0.82 L3MBTL1 (0.54) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7661366 0.81 L3MBTL1 (0.39) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7668047 0.81 TDP1 (0.51) KDM4EMAPTL3MBTL1KMT2ATDP1
SCHEMBL7668045 0.81 TDP1 (0.51) KDM4EMAPTL3MBTL1KMT2ATDP1

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
US-6344462-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-02-05 US disclosed
US-6100284-A ANTIALLERGENS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-08 US disclosed
US-6008229-A TREATING ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0861243-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-02 EP disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed