SCHEMBL7950320

SCHEMBL7950320

CCc1cc2c(cc1C(=O)CBr)C(C)(C)CCC2(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.57
RXRG P48443 5/20 0.50
RARA P10276 4/20 0.50
RARB P10826 4/20 0.50
RARG P13631 4/20 0.50
RXRB P28702 4/20 0.50
CXCR2 P25025 1/20 0.42
HNF4A P41235 2/20 0.41
MEN1 O00255 1/20 0.38
CYP26A1 O43174 1/20 0.38
ABCB11 O95342 1/20 0.38
ESR1 P03372 1/20 0.38
PGR P06401 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD1 P21728 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 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
SCHEMBL7217889 0.83 RXRA (0.72) RXRARXRGRARARARBRARG
SCHEMBL12620623 0.82 RXRA (0.55) RXRARXRGRARARARBRARG
SCHEMBL29395963 0.81 RXRA (0.61) RXRARXRGRARARARBRARG
SCHEMBL872423 0.81 RXRA (0.61) RXRARXRGRARARARBRARG
SCHEMBL7946771 0.79 RXRA (0.52) RXRARXRGRARARARBRARG
Acetic Acid SCHEMBL5879410 0.79 RXRA (0.62) RXRARXRGRARARARBRARG
SCHEMBL8494220 0.76 RXRA (0.49) RXRARXRGRARARARBRARG
SCHEMBL5540284 0.73 RXRA (0.80) RXRARXRGRARARARBRARG
SCHEMBL1072441 0.73 RXRA (1.00) RXRARXRGRARARARBRARG
SCHEMBL1550094 0.72 CYP3A4 (0.59) RXRARXRGRARARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435181-B2 Formulations capable of reacting with or removal of molecular oxygen LI SHENSHEN (US) 2025-10-07 US disclosed
US-20220235174-A1 Formulations capable of reacting with or removal of molecular oxygen LI ZHENZHEN (CN) 2022-07-28 US disclosed
CN-113966271-A Agent capable of reacting with or removing oxygen molecules 李蓁蓁 2022-01-21 CN disclosed
EP-3924160-A1 FORMULATIONS CAPABLE OF REACTING WITH OR REMOVAL OF MOLECULAR OXYGEN Finite Research Ltd (GB) 2021-12-22 EP disclosed
WO-2020154728-A1 FORMULATIONS CAPABLE OF REACTING WITH OR REMOVAL OF MOLECULAR OXYGEN LI SHENSHEN (US) 2020-07-30 WO disclosed
US-8436186-B2 Thiazolyl piperidine derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-05-07 US disclosed
US-20110105505-A1 THIAZOLYL PIPERIDINE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2011-05-05 US disclosed
US-20110105505-A1 THIAZOLYL PIPERIDINE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2011-05-05 US disclosed
US-6258854-B1 KETONE ETHERS FOR ODORS GIVAUDAN ROURE ( INTERNATIONAL ) SA (CH) 2001-07-10 US disclosed
EP-0983990-A2 Ketones useful as precursors for organoleptic compounds Givaudan Roure (International) S.A. (CH) 2000-03-08 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-20110105505-A1 THIAZOLYL PIPERIDINE DERIVATIVES SPHK1, S1PR1, SPHK2 RXRA 1255/4885RXRG 1746/4885RARA 1348/4885

“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.