SCHEMBL10945217

SCHEMBL10945217

CCCCCCCCCCCCCCCC(=O)OC1=C(c2ccc(C)cc2)C(=O)CC(C)(C)C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.37
▸ POLM Q9NP87 1/20 0.37
▸ POLK Q9UBT6 1/20 0.37
▸ POLL Q9UGP5 1/20 0.37
▸ POLH Q9Y253 1/20 0.37
▸ MGAT2 Q10469 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ ALOX15 P16050 1/20 0.34
▸ PRKCA P17252 1/20 0.34

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
SCHEMBL10946309 1.00 KMT2A (0.40) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10948746 1.00 KMT2A (0.40) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10947331 0.99 KMT2A (0.38) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10946604 0.90 GAA (0.39) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10942813 0.90 KMT2A (0.40) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10951881 0.88 KMT2A (0.40) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10945418 0.88 KMT2A (0.38) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10950579 0.85 HPGD (0.41) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10951657 0.84 TOP2A (0.41) KMT2ASMN1; SMN2NPSR1POLMPOLK
SCHEMBL10733838 0.84 KMT2A (0.38) KMT2ASMN1; SMN2POLMPOLKPOLL

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-4526723-A Microbiocides UNION CARBIDE CORPORATION (US) 1985-07-02 — — US disclosed
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