SCHEMBL7145211

SCHEMBL7145211

CC(C)(C)c1c(O)cccc1CCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
IAPP P10997 3/20 0.37
HSPA5 P11021 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HTR2A P28223 1/20 0.35
CA2 P00918 1/20 0.34
TRPA1 O75762 1/20 0.34
ATM Q13315 1/20 0.34
HTR1A P08908 1/20 0.33
BID P55957 3/20 0.33
MCL1 Q07820 3/20 0.33
BCL2L1 Q07817 2/20 0.33
BAK1 Q16611 2/20 0.33

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
SCHEMBL8196597 0.85 GABRA1 (0.43) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL10715136 0.84 GABRA1 (0.41) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL29475280 0.82 HSPA5 (0.50) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL31243576 0.81 BID (0.47) GABRA1GABRB2IAPPBIDMCL1
SCHEMBL6407131 0.80 GABRA1 (0.58) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL688631 0.79 BID (0.56) TSHRTDP1BIDMCL1BCL2L1
SCHEMBL419708 0.76 ALDH1A1 (0.52) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL4871845 0.74 GABRA1 (0.50) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL27491083 0.74 BCL2 (0.50) ALDH1A1TSHRTDP1HSPA5HTR2A
SCHEMBL1917838 0.74 TRPA1 (0.48) GABRA1GABRB2TSHRIAPPHSPA5

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-6515051-B2 Stability and durability and a low loss rate when incorporated into automotive coatings; soluble in a variety of substrates including thermoplastic polymers and often are colorless CIBA SPECIALTY CHEMICALS CORPORATION 2003-02-04 US disclosed
US-20020099221-A1 Benzotriazole UV absorbers having enhanced durability RAVICHANDRAN RAMANATHAN (US) 2002-07-25 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-20020099221-A1 Benzotriazole UV absorbers having enhanced durability TERT, AHR, ARNT GABRA1 356/4885GABRB2 188/4885ALDH1A1 970/4885

“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.