SCHEMBL3130489

SCHEMBL3130489

Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(-c4csc(CNCCN5CCOCC5)n4)ccc3n(C)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ FGFR1 P11362 2/20 0.36
▸ SRC P12931 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ DDR1 Q08345 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ TNKS2 Q9H2K2 1/20 0.35
▸ STK4 Q13043 1/20 0.35
▸ STK3 Q13188 1/20 0.35
▸ SIK2 Q9H0K1 1/20 0.35
▸ STK26 Q9P289 1/20 0.35
▸ STK24 Q9Y6E0 1/20 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
Hydrochloric Acid SCHEMBL1337067 0.99 AR (0.37) ARMAPK1LMNAUSP2FGFR1
SCHEMBL1339381 0.90 STAT1 (0.40) ARMAPK1LMNAKMT2AALDH1A1
SCHEMBL3140152 0.85 HTT (0.38) MAPK1LMNAUSP2FGFR1SRC
Hydrochloric Acid SCHEMBL1339128 0.85 HTT (0.38) MAPK1LMNAUSP2FGFR1SRC
SCHEMBL1339436 0.83 EIF4E (0.38) LMNAALDH1A1CNR1EGFRSMN1; SMN2
SCHEMBL1339348 0.83 PARP1 (0.43) ALDH1A1CNR1EGFR
SCHEMBL1339161 0.82 EIF4E (0.39) ALDH1A1CNR1EGFRSMN1; SMN2
SCHEMBL1339047 0.82 EIF4E (0.37) ARLMNAALDH1A1CNR1EGFR
SCHEMBL1338822 0.82 PARP1 (0.37) LMNAALDH1A1CNR1EGFRSMN1; SMN2
SCHEMBL1338539 0.81 L3MBTL1 (0.37) ALDH1A1NPSR1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940840-B1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-07-21 — — EP disclosed
EP-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 — — EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 — — WO disclosed
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