SCHEMBL11207992

SCHEMBL11207992

CC(C)C(CCC(=O)O)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.50
GABRD O14764 2/20 0.50
GABRA1 P14867 2/20 0.50
GABRB1 P18505 2/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRA5 P31644 2/20 0.50
GABRA3 P34903 2/20 0.50
GABRA2 P47869 2/20 0.50
GABRB2 P47870 2/20 0.50
GABRA4 P48169 2/20 0.50
GABRE P78334 2/20 0.50
GABRA6 Q16445 2/20 0.50
GABRG1 Q8N1C3 2/20 0.50
GABRG3 Q99928 2/20 0.50
GABRQ Q9UN88 2/20 0.50
CYP1A2 P05177 2/20 0.50
FOLH1 Q04609 4/20 0.48
TET2 Q6N021 3/20 0.46
KDM4A O75164 2/20 0.46

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
SCHEMBL14360449 0.87 GABRP (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8351683 0.86 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL14359924 0.86 LMNA (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7760623 0.86 LMNA (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28977861 0.86 LMNA (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28977862 0.86 LMNA (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27998711 0.83 FFAR4 (0.48)
SCHEMBL22471963 0.83 FFAR4 (0.48)
SCHEMBL13485688 0.82 CYP1A2 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL5960145 0.82 SMN1; SMN2 (0.48) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111691002-B Preparation method of high-strength low-modulus modified polyamide 56 industrial yarn 浙江恒逸石化研究院有限公司 2023-03-24 CN claimed
CN-111691002-A Preparation method of high-strength low-modulus modified polyamide 56 industrial yarn 浙江恒澜科技有限公司 2020-09-22 CN claimed
US-20230159426-A1 LILY OF THE VALLEY ODORANT FIRMENICH & CIE (CH) 2023-05-25 US disclosed
CN-111691002-B Preparation method of high-strength low-modulus modified polyamide 56 industrial yarn 浙江恒逸石化研究院有限公司 2023-03-24 CN disclosed
EP-4103537-A1 LILY OF THE VALLEY ODORANT Firmenich SA (CH) 2022-12-21 EP disclosed
CN-115210211-A Lily of the valley odorant 弗门尼舍有限公司 2022-10-18 CN disclosed
CN-111691002-A Preparation method of high-strength low-modulus modified polyamide 56 industrial yarn 浙江恒澜科技有限公司 2020-09-22 CN disclosed
WO-2019110355-A1 BRANCHED ADIPIC ACID BASED ESTERS AS NOVEL BASE STOCKS AND LUBRICANTS BASF SE (DE) 2019-06-13 WO disclosed
US-9340691-B2 Hot melt ink composition comprising a copolyester and process for preparing a copolyester OCE-TECHNOLOGIES B.V. (NL) 2016-05-17 US disclosed
EP-2596960-B1 Reusable print medium and method of manufacturing thereof OCE TECH BV (NL) 2016-04-20 EP disclosed
US-8809432-B2 Reusable print medium and method of manufacturing thereof OCE TECHNOLOGIES B.V. (NL) 2014-08-19 US disclosed
EP-2726564-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-Technologies B.V. (NL) 2014-05-07 EP disclosed
US-20140114013-A1 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2014-04-24 US disclosed
US-20130137805-A1 REUSABLE PRINT MEDIUM AND METHOD OF MANUFACTURING THEREOF OCE TECHNOLOGIES B.V. (NL) 2013-05-30 US disclosed
EP-2596960-A2 Reusable print medium and method of manufacturing thereof Océ-Technologies B.V. (NL) 2013-05-29 EP disclosed
WO-2013000761-A2 HOT MELT INK COMPOSITION COMPRISING A COPOLYESTER AND PROCESS FOR PREPARING A COPOLYESTER OCE-TECHNOLOGIES B.V. (NL) 2013-01-03 WO disclosed
EP-0093853-A1 Substituted derivatives of 3-isopropyl cyclopentanone, their preparation and use as perfumes and compositions containing these derivatives HÜLS AKTIENGESELLSCHAFT (DE) 1983-11-16 EP disclosed
EP-0093852-A1 Macrocyclic dicarboxylic-acid esters, process for preparing them and their use in odorous compositions HÜLS AKTIENGESELLSCHAFT (DE) 1983-11-16 EP disclosed
EP-0071358-A2 Benzopyrano(2,3-d)-v-triazole intermediates BEECHAM GROUP PLC (GB) 1983-02-09 EP disclosed
EP-0054398-A1 Pharmacologically active benzopyrano-(2,3-d)-v-triazoles BEECHAM GROUP PLC (GB) 1982-06-23 EP 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-20230159426-A1 LILY OF THE VALLEY ODORANT ACLY, PIR, NOX5 GABRP 2475/4885GABRD 3902/4885GABRA1 3750/4885

“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.