SCHEMBL3482638

SCHEMBL3482638

CC(Cc1ccccc1)OC(=O)/C=C/C(=O)OC(C)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.53
CTSK P43235 2/20 0.49
CTSL P07711 1/20 0.49
CTSB P07858 1/20 0.49
CTSH P09668 1/20 0.49
TAAR1 Q96RJ0 2/20 0.49
TSHR P16473 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CYP1A2 P05177 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SRR Q9GZT4 1/20 0.44
ALPI P09923 1/20 0.44
PKM P14618 1/20 0.44
PTGS1 P23219 1/20 0.44
XIAP P98170 1/20 0.44
SLC7A5 Q01650 1/20 0.44
TRPA1 O75762 1/20 0.44

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
SCHEMBL3482808 1.00 HCAR2 (0.53) HCAR2CTSKCTSLCTSBCTSH
SCHEMBL3482646 0.95 HCAR2 (0.61) HCAR2CTSKCTSLCTSBCTSH
SCHEMBL3515945 0.95 TSHR (0.53) HCAR2CTSKCTSLCTSBCTSH
SCHEMBL3482637 0.95 HCAR2 (0.61) HCAR2CTSKCTSLCTSBCTSH
SCHEMBL9646933 0.86 CTSK (0.47) CTSKCTSLCTSBCTSHTAAR1
SCHEMBL1838248 0.82 SLC6A2 (0.54) CTSKCTSLCTSBCTSHTAAR1
SCHEMBL6826673 0.82 TSHR (0.53) CTSKCTSLCTSBCTSHTAAR1
SCHEMBL31463338 0.82 ALDH1A1 (0.47) HCAR2CTSKCTSLCTSBCTSH
SCHEMBL9028692 0.81 ALDH1A1 (0.52) CTSKCTSLCTSBCTSHTAAR1
SCHEMBL5617244 0.81 ALDH1A1 (0.52) CTSKCTSLCTSBCTSHTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358972-B2 Pentacyclic heterocycles EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-14 US disclosed
EP-3936190-A1 PENTACYCLIC HETEROCYCLIC COMPOUND Eisai R&D Management Co., Ltd. (JP) 2022-01-12 EP disclosed
CN-113453762-A Pentacyclic heterocyclic compounds 卫材R&D管理有限公司 2021-09-28 CN disclosed
US-20200283452-A1 PENTACYCLIC HETEROCYCLES EISAI R&D MANAGEMENT CO., LTD. (JP) 2020-09-10 US disclosed
US-8420764-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2013-04-16 US disclosed
US-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-20120178894-A1 COMPOUND HAVING SILSESQUIOXANE SKELETON AND ITS POLYMER INAGAKI JYUN-ICHI (JP) 2012-07-12 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed
US-7705105-B2 A cyclic polymer of silsesquioxane skeleton with side chains formed byhydrosilation of an unsaturated end group containing an active polymerfunctional group; polyimidesiloxane copolymers; polyestersiloxane copolymers; high molecular weight; thin films; strength; heat resistance;waterproofing; CHISSO PETROCHEMICAL CORPORATION (JP) 2010-04-27 US disclosed
US-20070190344-A1 Verification of translation JNC CORPORATION (JP) 2007-08-16 US disclosed
US-20050009982-A1 Compound having silsesquioxane skeleton and its polymer CHISSO CORPORATION (JP) 2005-01-13 US 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 (3 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-11358972-B2 Pentacyclic heterocycles CYP2C19, CYP2C18, XDH HCAR2 996/4885CTSK 1825/4885CTSL 3333/4885
US-20200283452-A1 PENTACYCLIC HETEROCYCLES CYP2C19, CYP2C18, XDH HCAR2 996/4885CTSK 1825/4885CTSL 3333/4885
US-20050009982-A1 Compound having silsesquioxane skeleton and its polymer C1S, H1-4, H1-0 HCAR2 2928/4885CTSK 3554/4885CTSL 2965/4885

“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.