SCHEMBL5238458

SCHEMBL5238458

NN=C(Cc1ccnc2ccccc12)c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.46
CYP1A2 P05177 1/20 0.46
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PABPC1 P11940 1/20 0.40
EIF4H Q15056 1/20 0.40
IDO1 P14902 2/20 0.40
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
STAT1 P42224 1/20 0.39
ALDH1A1 P00352 2/20 0.38
NCF1 P14598 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 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
SCHEMBL5238455 1.00 LOXL2 (0.46) LOXL2CYP1A2FLT1KDRKMT2A
SCHEMBL5238056 0.89 CYP1A2 (0.54) LOXL2CYP1A2KMT2AMEN1RAB9A
SCHEMBL5238727 0.89 CYP1A2 (0.54) LOXL2CYP1A2KMT2AMEN1RAB9A
SCHEMBL5234952 0.86 LOXL2 (0.46) LOXL2CYP1A2KMT2AMEN1L3MBTL1
SCHEMBL5234948 0.86 LOXL2 (0.46) LOXL2CYP1A2KMT2AMEN1L3MBTL1
SCHEMBL5241399 0.86 FADS1 (0.46) LOXL2CYP1A2FLT1KDRKMT2A
SCHEMBL5241402 0.86 FADS1 (0.46) LOXL2CYP1A2FLT1KDRKMT2A
SCHEMBL5237502 0.83 LOXL2 (0.43) LOXL2CYP1A2FLT1KDRNCF1
SCHEMBL5235015 0.83 LOXL2 (0.43) LOXL2CYP1A2FLT1KDRNCF1
SCHEMBL5234728 0.82 LOXL2 (0.44) LOXL2CYP1A2FLT1KDRL3MBTL1

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-1397364-B1 NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS LILLY CO ELI (US) 2007-07-25 EP disclosed