SCHEMBL7718082

SCHEMBL7718082

CCN(C(=O)c1c(NC2CCCC2)c2c(Cl)cccc2n(C)c1=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ GAA P10253 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ TP53 P04637 1/20 0.42
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ PPARG P37231 1/20 0.40
▸ NCOA2 Q15596 1/20 0.40
▸ EGFR P00533 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ FGFR1 P11362 1/20 0.35
▸ HPGD P15428 2/20 0.35

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
SCHEMBL5166395 0.86 TP53 (0.47) MEN1KMT2ATP53NPC1EGFR
SCHEMBL19114836 0.82 TP53 (0.51) MEN1KMT2AMAPTTP53NPC1
Laquinimod SCHEMBL39440 0.81 TP53 (0.50) MEN1KMT2ATP53NPC1RAB9A
Laquinimod SCHEMBL29438575 0.81 TP53 (0.50) MEN1KMT2ATP53NPC1RAB9A
Laquinimod SCHEMBL1573702 0.80 TP53 (0.49) MEN1KMT2ATP53NPC1RAB9A
Laquinimod SCHEMBL1573337 0.80 TP53 (0.49) MEN1KMT2ATP53NPC1RAB9A
SCHEMBL19114839 0.80 TP53 (0.49) MEN1KMT2AGAAMAPTTP53
Laquinimod SCHEMBL1573704 0.80 TP53 (0.49) MEN1KMT2ATP53NPC1RAB9A
Laquinimod SCHEMBL1573491 0.80 TP53 (0.49) MEN1KMT2ATP53NPC1RAB9A
Laquinimod SCHEMBL1991182 0.79 TP53 (0.48) MEN1KMT2AGAATP53EGFR

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
US-6395750-B1 Includes laquinimod, N-ethyl-N-phenyl-1,2-dihydro-4-hydroxy-5-chloro-1-methyl-2-oxo-quinoline-3-carboxamide and its salts; breat or prostate cancer ACTIVE BIOTECH AB (SE) 2002-05-28 — — US disclosed
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