SCHEMBL19296576

SCHEMBL19296576

C=C(C)C(=O)OCCNC(=O)OCCN(CC)c1ccc2c(-c3ccccc3S(=O)(=O)NS(=O)(=O)C(F)(F)F)c3cc/c(=[N+](/CC)CCOC(=O)NCCOC(=O)C(=C)C)cc-3oc2c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ NCOR2 Q9Y618 1/20 0.43
▸ CHRM1 P11229 3/20 0.40
▸ SLC6A4 P31645 6/20 0.39
▸ SLC6A2 P23975 2/20 0.39
▸ SLC6A3 Q01959 2/20 0.39
▸ TGM2 P21980 1/20 0.39
▸ FPR2 P25090 4/20 0.37
▸ AVPR2 P30518 2/20 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
SCHEMBL19296572 0.97 MEN1 (0.46) MEN1USP2POLBPPARGBLM
SCHEMBL19296580 0.93 MEN1 (0.39) MEN1USP2POLBPPARGBLM
SCHEMBL19296578 0.93 MEN1 (0.37) MEN1USP2POLBPPARGBLM
SCHEMBL19296588 0.92 MEN1 (0.43) MEN1USP2POLBPPARGBLM
SCHEMBL19296585 0.92 MEN1 (0.47) MEN1USP2POLBPPARGBLM
SCHEMBL19296577 0.92 CHRM1 (0.37) MEN1USP2POLBPPARGBLM
SCHEMBL19296583 0.92 MEN1 (0.39) MEN1USP2POLBPPARGBLM
SCHEMBL19296592 0.89 MEN1 (0.44) MEN1USP2POLBPPARGBLM
SCHEMBL19296571 0.89 MEN1 (0.50) MEN1USP2POLBPPARGBLM
SCHEMBL19296579 0.88 MEN1 (0.46) MEN1USP2POLBPPARGBLM

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-20170248846-A1 COMPOUND, POLYMER, PHOTOSENSITIVE RESIN COMPOSITION, AND COLOR FILTER SAMSUNG SDI CO., LTD. (KR) 2017-08-31 — — US disclosed
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