SCHEMBL11670385

SCHEMBL11670385

CC(OC(=O)Oc1ccc(C2CCCCC2)cc1)N(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 4/20 0.38
▸ APP P05067 1/20 0.38
▸ CASP1 P29466 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ NAAA Q02083 1/20 0.36
▸ NPY5R Q15761 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ ELANE P08246 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
SCHEMBL11670273 0.85 STAT3 (0.38) STAT3APPCASP1ALDH1A1MAPT
SCHEMBL11671253 0.82 L3MBTL1 (0.46) PKMALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11670566 0.82 UBE2M (0.38) STAT3ALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL11676220 0.81 SLC6A2 (0.37) STAT3CASP1PKMALDH1A1LMNA
SCHEMBL11671956 0.80 CYP1A2 (0.45) PKMALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11671285 0.80 ALDH1A1 (0.44) ALDH1A1LMNAMAPTSMN1; SMN2RAB9A
SCHEMBL11672199 0.80 KDM4E (0.46) ALDH1A1LMNAHPGDMAPTSMN1; SMN2
SCHEMBL11671262 0.79 KMT2A (0.48) PKMALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11672424 0.79 LMNA (0.51) LMNAMAPTSMN1; SMN2RAB9ANPY5R
SCHEMBL248211 0.78 ALDH1A1 (0.51) STAT3CASP1ALDH1A1HIF1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4039526-A PRINTING, POLYACRYLONITRILE, POLYESTERS, POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
US-4039539-A 1,2,4-Triazole-azo-aniline cationic dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-08-02 — — US disclosed
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