SCHEMBL9622162

SCHEMBL9622162

CCCCCCSCC(=O)CC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.53
▸ CYP2C9 P11712 2/20 0.53
▸ GMNN O75496 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ NAAA Q02083 1/20 0.49
▸ CES2 O00748 5/20 0.49
▸ PLA2G4B P0C869 6/20 0.48
▸ CES1 P23141 7/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL28437029 0.89 MAPT (0.58) MAPTCYP2C9GMNNTP53POLB
SCHEMBL14998165 0.89 MAPT (0.58) MAPTCYP2C9GMNNTP53POLB
SCHEMBL6465332 0.89 MAPT (0.58) MAPTCYP2C9GMNNTP53POLB
SCHEMBL15457916 0.89 MAPT (0.58) MAPTCYP2C9GMNNTP53POLB
SCHEMBL9185052 0.88 CES1 (0.48) MAPTNAAACES2PLA2G4BCES1
SCHEMBL2522380 0.87 ALDH1A1 (0.58) MAPTCYP2C9GMNNTP53POLB
SCHEMBL10647153 0.83 HDAC1 (0.53) MAPTCYP2C9PLA2G4BCES1CYP3A4
SCHEMBL8756244 0.82 ALDH1A1 (0.59) MAPTCYP2C9GMNNTP53POLB
SCHEMBL10886619 0.82 KMT2A (0.64) MAPTCYP2C9CES1CYP3A4HPGD
SCHEMBL3357504 0.81 L3MBTL1 (0.55) MAPTCYP2C9GMNNTP53POLB

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-0307358-B1 1,3-DIKETONES CONTAINING ETHERS OR THIOETHERS AND THEIR USE AS STABILISING AGENTS IN CHLORINATED POLYMERS CIBA-GEIGY AG (CH) 1992-02-12 — — EP disclosed
US-4992504-A Heat resistance, photostability CIBA-GEIGY CORPORATION (US) 1991-02-12 — — US disclosed
EP-0307358-A1 1,3-Diketones containing ethers or thioethers and their use as stabilising agents in chlorinated polymers CIBA-GEIGY AG (CH) 1989-03-15 — — EP disclosed
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