SCHEMBL7014608

SCHEMBL7014608

Cc1ccc2nc(-c3ccccc3Br)nc(Cl)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
MAOB P27338 2/20 0.40
MAOA P21397 2/20 0.40
TP53 P04637 2/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
METAP1 P53582 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL11825482 0.80 LMNA (0.58) LMNAMAPTKDM4EALDH1A1TP53
SCHEMBL3973898 0.77 LMNA (0.45) LMNAMAPTKDM4EALDH1A1MAOB
SCHEMBL14843585 0.74 LMNA (0.56) LMNAMAPTKDM4EALDH1A1MAOA
SCHEMBL7014298 0.74 MAOB (0.46) MAPTKDM4EALDH1A1MAOBMAOA
SCHEMBL14726233 0.73 PDE5A (0.60) LMNAMAPTKDM4EALDH1A1TP53
Hydrochloric Acid SCHEMBL7280690 0.72 PDE5A (0.61) LMNAMAPTKDM4EALDH1A1TP53
SCHEMBL4714151 0.71 RXFP1 (0.43) MAPTMAPK1SMN1; SMN2METAP1KMT2A
SCHEMBL1622585 0.71 ALK (0.46) MAPTALDH1A1L3MBTL1SMN1; SMN2KMT2A
SCHEMBL183759 0.71 KMT2A (0.52) LMNAMAPTKDM4EALDH1A1MAPK1
SCHEMBL1621274 0.71 THRB (0.52) LMNAKDM4EALDH1A1TP53MAPK1

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
EP-1327631-A2 Fused heterocyclic compounds, their production and use as angiotensin II antagonists Takeda Chemical Industries, Ltd. (JP) 2003-07-16 EP disclosed
EP-0518033-B1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-07-02 EP disclosed
US-5389641-A Fused heterocyclic compounds, having angiotensin II antagonistic activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US disclosed
EP-0518033-A1 Fused heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-16 EP disclosed