SCHEMBL23960

SCHEMBL23960

CC(CC=O)CC1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 3/20 0.38
ADH1A P07327 3/20 0.38
ADH1B P00325 2/20 0.38
ADH4 P08319 1/20 0.38
ADH7 P40394 1/20 0.38
CTSK P43235 8/20 0.35
CTSL P07711 5/20 0.35
CTSB P07858 5/20 0.35
CTSH P09668 3/20 0.33
LTA4H P09960 1/20 0.33

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
SCHEMBL24601 0.98 ADH1B (0.34) ADH1CADH1AADH1BADH4ADH7
SCHEMBL18664140 0.89
SCHEMBL7879516 0.80 METAP1 (0.41) ADH1CADH1AADH1BADH4ADH7
SCHEMBL3155857 0.79 CYP1A2 (0.40) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL6748871 0.79 CTSK (0.32) CTSKCTSLCTSB
SCHEMBL6564265 0.78 METAP1 (0.38) ADH1CADH1AADH1BADH4ADH7
SCHEMBL15173337 0.76 CTSK (0.37) ADH1CADH1AADH1BADH4ADH7
SCHEMBL28022207 0.76 CYP1A2 (0.42)
Propionaldehyde SCHEMBL27200261 0.75 CTSK (0.38) ADH1CADH1AADH1BADH4ADH7
SCHEMBL21008653 0.75 ADH1B (0.38) ADH1CADH1AADH1BADH4ADH7

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107254358-A Synthesis of flavoring agent 卡达·拉梅什·瓦兹 2017-10-17 CN claimed
CN-103210074-B Synthesis of flavoring agent 卡达·拉梅什·瓦兹 2017-03-29 CN claimed
EP-2609184-B1 PERFUMERY COMPOSITIONS AND SYNTHESIS OF A ODORANT VAZE KEDAR RAMESH (IN) 2017-02-15 EP claimed
CN-103210074-A Synthesis of a novel odorant VAZE KEDAR RAMESH 2013-07-17 CN claimed
EP-2609184-A1 SYNTHESIS OF A NOVEL ODORANT Vaze, Kedar Ramesh (IN) 2013-07-03 EP claimed
US-20130157923-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2013-06-20 US claimed
WO-2012025934-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2012-03-01 WO claimed
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 US disclosed
EP-3556781-A1 RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN Sumitomo Chemical Company, Limited (JP) 2019-10-23 EP disclosed
US-9845443-B2 Synthesis of a novel odorant VAZE KEDAR RAMESH (IN) 2017-12-19 US disclosed
US-9845443-B2 Synthesis of a novel odorant VAZE KEDAR RAMESH (IN) 2017-12-19 US disclosed
US-9845443-B2 Synthesis of a novel odorant VAZE KEDAR RAMESH (IN) 2017-12-19 US disclosed
CN-107254358-A Synthesis of flavoring agent 卡达·拉梅什·瓦兹 2017-10-17 CN disclosed
CN-103210074-A Synthesis of a novel odorant VAZE KEDAR RAMESH 2013-07-17 CN disclosed
EP-2609184-A1 SYNTHESIS OF A NOVEL ODORANT Vaze, Kedar Ramesh (IN) 2013-07-03 EP disclosed
US-20130157923-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2013-06-20 US disclosed
US-20130157923-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2013-06-20 US disclosed
US-20130157923-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2013-06-20 US disclosed
WO-2012025934-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2012-03-01 WO disclosed
WO-2012025934-A1 SYNTHESIS OF A NOVEL ODORANT VAZE KEDAR RAMESH (IN) 2012-03-01 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-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 ADH1C 848/4885ADH1A 582/4885ADH1B 1034/4885

“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.