SCHEMBL3905950

SCHEMBL3905950

CCCCCCCCCc1cccc2c1C(CCCCCCCCC)(c1ccccc1)C(=O)O2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.50
MMP9 P14780 4/20 0.50
MMP3 P08254 2/20 0.50
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
PPARA Q07869 2/20 0.39
PPARG P37231 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
LIPG Q9Y5X9 1/20 0.38

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
SCHEMBL3897034 0.81 MMP2 (0.56) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3896300 0.81 MMP2 (0.56) MMP2MMP9MMP3MMP8MMP13
SCHEMBL29010133 0.80 MMP2 (0.65) MMP2MMP9MMP3MMP8MMP13
SCHEMBL4449571 0.75 MMP2 (0.48) MMP2MMP9MMP3MMP8MMP13
SCHEMBL27807652 0.73 SCN9A (0.37) MMP2MMP9MMP3MMP8MMP13
SCHEMBL27457527 0.72 CTRC (0.37) BIDMCL1BCL2L1BAK1KAT8
Benzene SCHEMBL8729420 0.66 LIPG (0.67) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL7054345 0.66 LIPG (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL29432879 0.66 LIPG (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL18153979 0.66 LIPG (0.49) BIDMCL1BCL2L1BAK1KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6224791-B1 PHENYLBENZOFURAN-2-ONE WITH PHOSPHITE DOVER CHEMICAL CORPORATION 2001-05-01 US claimed
WO-1999003915-A1 LACTONE/PHOSPHITE BLENDS DOVER CHEMICAL CORPORATION (US) 1999-01-28 WO claimed
EP-1692150-A4 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES DOVER CHEMICAL CORP (US) 2009-02-25 EP disclosed
US-7470735-B2 Phenol-free phosphites DOVER CHEMICAL CORPORATION (US) 2008-12-30 US disclosed
US-7342060-B2 Process for manufacture of pentaerythritol diphosphites DOVER CHEMICAL CORPORATION (US) 2008-03-11 US disclosed
EP-1692150-A2 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES Dover Chemical Corporation (US) 2006-08-23 EP disclosed
WO-2005113665-A2 PHENOL-FREE PHOSPHITES DOVER CHEMICAL CORPORATION (US) 2005-12-01 WO disclosed
WO-2005060500-A2 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES DOVER CHEMICAL CORPORATION (US) 2005-07-07 WO disclosed
US-20050131244-A1 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES DOVER CHEMICAL CORPORATION (US) 2005-06-16 US disclosed
US-20040180999-A1 PHENOL-FREE PHOSPHITES DOVER CHEMICAL CORPORATION (US) 2004-09-16 US disclosed
US-6770693-B2 COMPRISING BIS-(2,4-DICUMYLPHENYL) PENTAERYTHRITOL DIPHOSPHITE AND HINDERED PHENOL ANTIOXIDANTS USEFUL AS STABILIZERS AGAINST THERMOOXIDATIVE DEGRADATION OF POLYMERS DURING MELT PROCESSING DOVE CHEMICAL CORPORATION 2004-08-03 US disclosed
US-20020040081-A1 Blends of phosphites and antioxidants DOVER CHEMICAL 2002-04-04 US disclosed
US-6224791-B1 PHENYLBENZOFURAN-2-ONE WITH PHOSPHITE DOVER CHEMICAL CORPORATION 2001-05-01 US disclosed
WO-1999003915-A1 LACTONE/PHOSPHITE BLENDS DOVER CHEMICAL CORPORATION (US) 1999-01-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050131244-A1 PROCESS FOR MANUFACTURE OF PENTAERYTHRITOL DIPHOSPHITES GNPAT, DCTPP1, DERA MMP2 3937/4885MMP9 4578/4885MMP3 4744/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.