SCHEMBL20019785

SCHEMBL20019785

O=C1c2cccc(-n3c4ccccc4c4ccccc43)c2C(=O)N1c1ccc(N2C(=O)c3c(cccc3-n3c4ccccc4c4ccccc43)C2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSPA1A P0DMV8 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ ATM Q13315 2/20 0.38
▸ POLB P06746 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ RECQL P46063 2/20 0.36
▸ CASP6 P55212 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ APOBEC3A P31941 1/20 0.36
▸ APOBEC3G Q9HC16 1/20 0.36

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
SCHEMBL19621722 0.97 RAB9A (0.40) RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1
SCHEMBL22600864 0.86 ALDH1A1 (0.42) RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1
SCHEMBL17622328 0.85 HSPA1A (0.50) RAB9AALDH1A1SMN1; SMN2NPC1HSPA1A
SCHEMBL19430981 0.83 MEN1 (0.45) RAB9ASMN1; SMN2NPC1MEN1KMT2A
SCHEMBL17622330 0.81 PDE6D (0.48) RAB9AALDH1A1SMN1; SMN2NPC1HSPA1A
SCHEMBL17622234 0.81 HSPA1A (0.56) ALDH1A1HSD17B10SMN1; SMN2HSPA1APABPC1
SCHEMBL24282769 0.80 RAB9A (0.37) RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1
SCHEMBL17622208 0.79 PGR (0.45) ALDH1A1SMN1; SMN2HSPA1APABPC1MEN1
SCHEMBL19421866 0.77 HSPA1A (0.48) ALDH1A1SMN1; SMN2HSPA1APABPC1MEN1
SCHEMBL24282771 0.77 RAB9A (0.38) RAB9AALDH1A1HSD17B10SMN1; SMN2NPC1

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-3137574-B1 ORGANIC MOLECULES FOR USE AS EMITTERS CYNORA GMBH (DE) 2018-04-04 — — EP disclosed
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