SCHEMBL9042883

SCHEMBL9042883

CCn1nc(N)c(=O)c2cc(Br)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.42
▸ MAPK8 P45983 2/20 0.41
▸ PDGFRA P16234 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ TYRO3 Q06418 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ ADORA2A P29274 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ELANE P08246 2/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ PDPK1 O15530 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ESR1 P03372 1/20 0.34

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
SCHEMBL9042310 0.84 KDM4C (0.43) LMNAMAPK8ALDH1A1KDM4ETSHR
SCHEMBL9043059 0.82 MAPK8 (0.53) LMNAMAPK8ALDH1A1KDM4ETSHR
SCHEMBL9041922 0.78 ALDH1A1 (0.51) ALDH1A1KDM4EMAPTHTTCDK1
SCHEMBL25886396 0.75 ADORA2A (0.40) LMNAALDH1A1ADORA2AADORA2BSMN1; SMN2
SCHEMBL9040334 0.74 KDM4E (0.67) LMNAALDH1A1KDM4ETSHRBLM
SCHEMBL9041780 0.73 BRD9 (0.40) LMNAALDH1A1KDM4ETSHRBLM
SCHEMBL9042400 0.73 MAPK8 (0.44) MAPK8CDK5ADORA2AADORA2BPDPK1
SCHEMBL1967294 0.73 LMNA (0.49) LMNAPDGFRACDK5TYRO3ALDH1A1
SCHEMBL29122205 0.73 ADORA2A (0.38) LMNAMAPK8ADORA2AADORA2BSMN1; SMN2
SCHEMBL11753420 0.71 AKR1B1 (0.54) MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0613470-B1 NOVEL 4-CINNOLINONE DERIVATIVES, THEIR PREPARATION AND APPLICATION IN THERAPY PF MEDICAMENT (FR) 1996-01-10 — — EP claimed
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