SCHEMBL4576587

SCHEMBL4576587

CCc1cc(OC)c(C(C)C)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.59
TAAR1 Q96RJ0 1/20 0.40
FOS P01100 1/20 0.39
TTR P02766 1/20 0.39
JUN P05412 1/20 0.39
NR3C1 P04150 1/20 0.39
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
CA2 P00918 1/20 0.39
TUBB1 Q9H4B7 1/20 0.37
ALOX15 P16050 3/20 0.36
ALOX12 P18054 3/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
HTR2B P41595 2/20 0.35
ALDH1A1 P00352 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
SCHEMBL27930394 0.84 TUBB4A (0.46) PTGS2FOSTTRJUNCA2
SCHEMBL27452655 0.84 PTGS2 (0.47) PTGS2TAAR1FOSTTRJUN
SCHEMBL918818 0.83 FOS (0.39) PTGS2FOSTTRJUNNR3C1
SCHEMBL27758290 0.81 TTR (0.42) PTGS2FOSTTRJUNNR3C1
SCHEMBL27022168 0.81 PTGS2 (0.57) PTGS2TAAR1FOSTTRJUN
SCHEMBL918623 0.81 THRB (0.44) PTGS2FOSTTRJUNNR3C1
SCHEMBL22031950 0.80 PTGS2 (0.38) PTGS2TAAR1FOSTTRJUN
SCHEMBL14484215 0.78 PTGS2 (0.53) PTGS2CA2TUBB1ALDH1A1
SCHEMBL14280291 0.78 ALDH1A1 (0.38) PTGS2FOSTTRJUNNR3C1
SCHEMBL29022512 0.78 ALDH1A1 (0.38) PTGS2FOSTTRJUNNR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295146-A1 INHIBITORS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES 1 AND 4 THE UNIVERSITY OF ROCHESTER 2023-09-21 US disclosed
US-9751966-B2 Rapid cure polymeric resins THE BOEING COMPANY (US) 2017-09-05 US disclosed
US-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues WELICHEM BIOTECH INC. (CA) 2008-10-16 US disclosed
US-7321050-B2 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues WELICHEM BIOTECH INC. (CA) 2008-01-22 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-20230295146-A1 INHIBITORS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES 1 AND 4 IRAK4, IRAK1, IRAK2 PTGS2 2915/4885TAAR1 1747/4885FOS 4090/4885
US-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues NFKBIA, IKBKB, IKBKE PTGS2 227/4885TAAR1 3016/4885FOS 2661/4885

“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.