SCHEMBL9621829

SCHEMBL9621829

CC(=O)CC(=O)CCCOc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.58
MTNR1A P48039 1/20 0.56
MTNR1B P49286 1/20 0.56
HPGD P15428 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
HDAC1 Q13547 1/20 0.53
HDAC2 Q92769 1/20 0.53
RECQL P46063 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
TAAR1 Q96RJ0 1/20 0.51
MAPT P10636 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KCNA3 P22001 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
GAA P10253 1/20 0.50

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
SCHEMBL8911825 0.86 HDAC1 (0.56) L3MBTL1HPGDMEN1KMT2AHDAC1
SCHEMBL4055883 0.85 L3MBTL1 (0.61) L3MBTL1MTNR1AMTNR1BHPGDMEN1
SCHEMBL10361230 0.85 KCNA3 (0.62) L3MBTL1HPGDMEN1KMT2AHDAC1
SCHEMBL17002035 0.82 RECQL (0.58) L3MBTL1HPGDMEN1KMT2AHDAC1
SCHEMBL15178062 0.81 LTA4H (0.55) L3MBTL1HPGDMEN1KMT2AHDAC1
SCHEMBL15061644 0.80 HDAC1 (0.62) L3MBTL1MTNR1AMTNR1BHDAC1HDAC2
SCHEMBL2222064 0.80 ALOX15 (0.59) L3MBTL1MTNR1AMTNR1BHPGDMEN1
SCHEMBL8278956 0.80 MTNR1A (0.59) L3MBTL1MTNR1AMTNR1BMEN1KMT2A
SCHEMBL10804736 0.79 L3MBTL1 (0.58) L3MBTL1MTNR1AMTNR1BHDAC1HDAC2
SCHEMBL9153257 0.79 EPHX2 (0.46) L3MBTL1SMN1; SMN2TSHRALDH1A1LMNA

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 5 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 claimed
US-4992504-A Heat resistance, photostability CIBA-GEIGY CORPORATION (US) 1991-02-12 US claimed
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