SCHEMBL13533488

SCHEMBL13533488

CC1CC(C)(CC(C)(C)c2ccccc2)c2ccc(C(=O)C(C)(C)O)cc21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
GRIN2B Q13224 1/20 0.30
CTNNB1 P35222 1/20 0.30
CNR2 P34972 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL22025006 0.82 ALDH1A1 (0.31) CYP2C19
SCHEMBL15613866 0.78 TAAR1 (0.36)
SCHEMBL23957703 0.77 RXRA (0.38) RXRARXRB
SCHEMBL9927799 0.77 RXRA (0.38) RXRARXRB
SCHEMBL18950054 0.77 ACHE (0.31)
SCHEMBL23136551 0.76 CYP1A2 (0.33) CYP2C19
SCHEMBL24140842 0.74
SCHEMBL23033699 0.70 RXRA (0.35) RXRARXRB
SCHEMBL9812184 0.69 RXRA (0.32) RXRARXRB
SCHEMBL9906973 0.68 RXRA (0.39) RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220064350-A1 LIMONENE-BASED (METH)ACRYLATES FOR USE IN 3D PRINTING BASF SE (DE) 2022-03-03 US disclosed
US-20100021831-A1 TRANSPARENT COLOURANTS AND COLOURANT COMPOSITIONS, AND THEIR USE CIBA CORPORATION (US) 2010-01-28 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 (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-20220064350-A1 LIMONENE-BASED (METH)ACRYLATES FOR USE IN 3D PRINTING LIMK1, LIMA1, LIMK2 RXRA 3175/4885RXRB 3179/4885GRIN2B 2548/4885
US-20100021831-A1 TRANSPARENT COLOURANTS AND COLOURANT COMPOSITIONS, AND THEIR USE NDUFA10, STARD10, RPS10 RXRA 559/4885RXRB 606/4885GRIN2B 2272/4885

“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.