SCHEMBL2808583

SCHEMBL2808583

CC1(C)CCC(C)(C)c2cc(C3(c4ccc(C(=O)O)cc4)SCCS3)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 15/20 1.00
CYP26B1 Q9NR63 5/20 1.00
CYP26A1 O43174 5/20 1.00
CYP3A4 P08684 2/20 0.67
RXRB P28702 10/20 0.66
RXRG P48443 6/20 0.61
RARB P10826 5/20 0.61
RARG P13631 5/20 0.61
RARA P10276 3/20 0.58
CRABP2 P29373 1/20 0.57

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
SCHEMBL5894384 0.95 RXRA (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL31061276 0.90 CYP26B1 (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL29391180 0.90 CYP26B1 (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL3454051 0.90 CYP26B1 (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL8708782 0.85 RXRA (0.74) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL30012842 0.84 RXRA (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL3453249 0.84 RXRA (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL7521288 0.84 RXRA (0.74) RXRACYP26B1CYP26A1RXRBRXRG
SCHEMBL8706133 0.81 RXRA (0.76) RXRACYP26B1CYP26A1CYP3A4RXRB
SCHEMBL17911582 0.81 CYP26B1 (1.00) RXRACYP26B1CYP26A1CYP3A4RXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495349-B1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS ORYZON GENOMICS SA (ES) 2023-06-28 EP disclosed
EP-4074695-A1 (HETERO)ARYL CYCLOPROPYLAMINE COMPOUNDS AS LSD1 INHIBITORS Oryzon Genomics, S.A. (ES) 2022-10-19 EP disclosed
US-9963439-B2 Specific inhibitors of cytochrome P450 26 retinoic acid hydroxylase UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2018-05-08 US disclosed
US-9963439-B2 Specific inhibitors of cytochrome P450 26 retinoic acid hydroxylase UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2018-05-08 US disclosed
US-20160200703-A1 NOVEL AND SPECIFIC INHIBITORS OF CYTOCHROME P450 26 RETINOIC ACID HYDROXYLASE UNIVERSITY OF MONTANA (US) 2016-07-14 US disclosed
US-20160200703-A1 NOVEL AND SPECIFIC INHIBITORS OF CYTOCHROME P450 26 RETINOIC ACID HYDROXYLASE UNIVERSITY OF MONTANA (US) 2016-07-14 US disclosed
US-20110300129-A1 SYSTEMS AND METHODS FOR ENHANCING VACCINE EFFICACY UNIVERSITY OF ROCHESTER (US) 2011-12-08 US disclosed
WO-2010075037-A1 SYSTEMS AND METHODS FOR ENHANCING VACCINE EFFICACY UNIVERSITY OF ROCHESTER (US) 2010-07-01 WO disclosed
US-5837725-A Bridged bicyclic aromatic compounds and their use in modulating gene expression of retinoid receptors SRI INTERNATIONAL (US) 1998-11-17 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 (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-20160200703-A1 NOVEL AND SPECIFIC INHIBITORS OF CYTOCHROME P450 26 RETINOIC ACID HYDROXYLASE CYP2B6, CYP26A1, CYP2A6 RXRA 15/4885CYP26B1 4/4885CYP26A1 2/4885

“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.