SCHEMBL2897683

SCHEMBL2897683

CCCc1cc2c(cc1C(C)=O)C(C)(C)CCC2(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.64
RXRB P28702 4/20 0.47
RXRG P48443 4/20 0.47
RARA P10276 4/20 0.47
RARB P10826 4/20 0.47
RARG P13631 4/20 0.47
HNF4A P41235 2/20 0.41
CYP26A1 O43174 1/20 0.39
CYP26B1 Q9NR63 1/20 0.39

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
SCHEMBL6910130 0.91 RXRA (0.62) RXRARXRBRXRGRARARARB
SCHEMBL872423 0.88 RXRA (0.61) RXRARXRBRXRGRARARARB
SCHEMBL29395963 0.88 RXRA (0.61) RXRARXRBRXRGRARARARB
Acetic Acid SCHEMBL5879410 0.85 RXRA (0.62) RXRARXRBRXRGRARARARB
SCHEMBL6668009 0.82 RXRA (0.47) RXRARXRBRXRGRARARARB
SCHEMBL8853218 0.82 RXRA (0.46) RXRARXRBRXRGRARARARB
SCHEMBL12418596 0.80 RXRA (0.50) RXRARXRBRXRGRARARARB
SCHEMBL1269026 0.79 RXRA (1.00) RXRARXRBRXRGRARARARB
SCHEMBL6679884 0.77 RXRA (0.64) RXRARXRBRXRGRARARARB
SCHEMBL6916396 0.77 RXRA (1.00) RXRARXRBRXRGRARARARB

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-7968602-B2 4-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthalenyl)-1-propenyl]benzoic acid analogs and method of manufacture and use thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-06-28 US disclosed
US-7968602-B2 4-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthalenyl)-1-propenyl]benzoic acid analogs and method of manufacture and use thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-06-28 US disclosed
US-20100029777-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-04 US disclosed
US-20100029777-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-04 US disclosed
US-7585894-B2 4-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthalenyl)-1-propenyl]benzoic acid analogs and method of manufacture and use thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-09-08 US disclosed
US-7585894-B2 4-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthalenyl)-1-propenyl]benzoic acid analogs and method of manufacture and use thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-09-08 US disclosed
EP-1896392-A1 A-[E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND AND USE THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-03-12 EP disclosed
US-20070015717-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF UNIVERSITY OF CALIFORNIA-LOS ANGELES 2007-01-18 US disclosed
US-20070015717-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF UNIVERSITY OF CALIFORNIA-LOS ANGELES 2007-01-18 US disclosed
WO-2007005568-A1 A-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND AND USE THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-01-11 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 (2 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-20100029777-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF BRCA1, TTPA, UGT2B7 RXRA 566/4885RXRB 773/4885RXRG 636/4885
US-20070015717-A1 4-[(E)-2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPTHALENYL)-1-PROPENYL]BENZOIC ACID ANALOGS AND METHOD OF MANUFACTURE AND USE THEREOF BRCA1, TTPA, UGT2B7 RXRA 566/4885RXRB 773/4885RXRG 636/4885

“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.