SCHEMBL3633427

SCHEMBL3633427

CC(C)(C)c1cc(C(=O)O)c2c(c1)C(C)(C)CC2

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRA P19793 17/20 0.65
RXRG P48443 9/20 0.51
RXRB P28702 10/20 0.46
TDP1 Q9NUW8 1/20 0.37
RARB P10826 3/20 0.35
RARG P13631 3/20 0.35
RARA P10276 2/20 0.35
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL112943 0.89 RXRA (0.63) RXRARXRGRXRBRARBRARG
SCHEMBL29374183 0.89 RXRA (0.63) RXRARXRGRXRBRARBRARG
SCHEMBL7088008 0.84 RXRA (0.61) RXRARXRGRXRBRARBRARG
SCHEMBL13807401 0.83 RXRA (0.57) RXRARXRGRXRB
SCHEMBL7081379 0.82 RXRA (0.59) RXRARXRGRXRBRARBRARG
SCHEMBL7081382 0.82 RXRA (0.59) RXRARXRGRXRBRARBRARG
SCHEMBL7080041 0.82 RXRA (0.56) RXRARXRGRXRBRARBRARG
SCHEMBL7800113 0.81 RXRA (0.58) RXRARXRGRXRBRARBRARG
SCHEMBL7085844 0.81 RXRA (0.60) RXRARXRGRXRB
Acetic Acid SCHEMBL8421363 0.81 RXRA (0.54) RXRARXRGRXRBTDP1RARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569535-B2 Substituted benzoylamino-indan-2-carboxylic acids and related compounds SANOFI (FR) 2013-10-29 US disclosed
US-8569535-B2 Substituted benzoylamino-indan-2-carboxylic acids and related compounds SANOFI (FR) 2013-10-29 US disclosed
US-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2010-05-06 US disclosed
US-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2010-05-06 US disclosed
EP-2155711-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS Sanofi-Aventis (FR) 2010-02-24 EP disclosed
WO-2008151211-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2008-12-11 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 (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-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS CXCR5, CXCR1, CCR5 RXRA 393/4885RXRG 432/4885RXRB 409/4885

“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.