SCHEMBL4392103

SCHEMBL4392103

CCOc1ccccc1C(=O)Oc1ccc(C)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.62
ESR2 Q92731 1/20 0.62
KMT2A Q03164 2/20 0.58
PTK2B Q14289 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
MAPT P10636 3/20 0.54
NPSR1 Q6W5P4 2/20 0.54
HPGD P15428 1/20 0.54
XBP1 P17861 1/20 0.54
LMNA P02545 2/20 0.53
TP53 P04637 1/20 0.53
HCRTR1 O43613 2/20 0.51
KCNMA1 Q12791 1/20 0.50
MEN1 O00255 1/20 0.50
PTGS2 P35354 1/20 0.50
L3MBTL1 Q9Y468 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
SCHEMBL538561 0.89 ESR1 (0.63) ESR1ESR2KMT2ACYP1A2CYP2C9
Bicarbonate SCHEMBL29983911 0.88 ESR1 (0.61) ESR1ESR2KMT2ACYP1A2CYP2C9
SCHEMBL4393205 0.85 PTK2B (0.52) ESR1ESR2KMT2APTK2BRXFP1
SCHEMBL4389475 0.84 NPSR1 (0.72) ESR1ESR2KMT2APTK2BRXFP1
SCHEMBL21986971 0.84 ESR1 (0.57) ESR1ESR2KMT2ACYP1A2CYP2C9
SCHEMBL4382990 0.83 CYP1A2 (0.65) ESR1KMT2APTK2BRXFP1CYP1A2
SCHEMBL31321662 0.82 MAPT (0.55) ESR1ESR2KMT2AMAPTNPSR1
SCHEMBL11768986 0.82 ESR1 (0.55) ESR1ESR2KMT2ACYP1A2CYP2C9
SCHEMBL208281 0.82 PTK2B (0.70) KMT2APTK2BRXFP1CYP1A2CYP3A4
SCHEMBL21449134 0.81 PTGS2 (0.68) ESR1KMT2APTK2BRXFP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56100742-A None JP disclosed
EP-1829854-B1 PROCESS FOR PRODUCING AROMATIC CARBONATE ASAHI KASEI CHEMICALS CORP (JP) 2013-09-04 EP disclosed
US-7629485-B2 Process for producing aromatic carbonate ASAHI KASEI CHEMICALS CORPORATION (JP) 2009-12-08 US disclosed
US-20080177099-A1 Process for Producing Aromatic Carbonate ASAHI KASEI KABUSHIKI KAISHA (JP) 2008-07-24 US disclosed
EP-1829854-A1 PROCESS FOR PRODUCING AROMATIC CARBONATE Asahi Kasei Chemicals Corporation (JP) 2007-09-05 EP disclosed
EP-1016648-B1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES ASAHI CHEMICAL IND (JP) 2003-05-14 EP disclosed
US-6262210-B1 TRANSESTERIFYING DIALKYL CARBONATE, ALKYL ARYL CARBONATE OR MIXTURE WITH AROMATIC MONOHYDROXY COMPOUND IN PRESENCE OF METAL CONTAINING CATALYST TO OBTAIN HIGH BOILING POINT REACTION MIXTURE CONTAINING AROMATIC CARBONATE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-07-17 US disclosed
EP-1016648-A1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-07-05 EP disclosed
JP-S56100742-A ETHOXYBENZOATE AND ANTIFUNGAL AGENT SHOWA DENKO KK 1981-08-12 JP 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-20080177099-A1 Process for Producing Aromatic Carbonate DCLK1, ALK, DCLK3 ESR1 790/4885ESR2 1426/4885KMT2A 2526/4885

“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.