SCHEMBL4931997

SCHEMBL4931997

CC(C)Nc1cc(COc2c(Cl)cc(NC(=O)CC(=O)O)cc2Cl)cc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TRPA1 O75762 2/20 0.42
LMNA P02545 1/20 0.42
TACR1 P25103 1/20 0.41
MRGPRX4 Q96LA9 5/20 0.39
MME P08473 1/20 0.36
ACE P12821 1/20 0.36
CPA1 P15085 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
RHOC P08134 1/20 0.36
RHOA P61586 1/20 0.36
ACP1 P24666 1/20 0.36
THRA P10827 3/20 0.36
THRB P10828 3/20 0.36
HTR2B P41595 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
SCHEMBL4929409 0.91 ALDH1A1 (0.43) ALDH1A1TRPA1LMNATACR1MRGPRX4
SCHEMBL5119858 0.91 LMNA (0.44) ALDH1A1LMNATACR1MRGPRX4RHOC
SCHEMBL4929444 0.90 ALDH1A1 (0.46) ALDH1A1TRPA1LMNATACR1MRGPRX4
SCHEMBL5110736 0.90 ALDH1A1 (0.46) ALDH1A1LMNATACR1MRGPRX4MME
SCHEMBL4931008 0.89 ALDH1A1 (0.46) ALDH1A1TRPA1LMNATACR1MRGPRX4
SCHEMBL4931364 0.89 LMNA (0.44) ALDH1A1LMNATACR1MRGPRX4RHOC
SCHEMBL5111277 0.89 ALDH1A1 (0.46) ALDH1A1LMNATACR1MRGPRX4RHOC
SCHEMBL5718040 0.88 THRB (0.38) ALDH1A1TRPA1LMNAMRGPRX4THRA
SCHEMBL4935433 0.87 TRPA1 (0.43) ALDH1A1TRPA1LMNATACR1MRGPRX4
SCHEMBL4926924 0.86 PPARD (0.45) ALDH1A1TRPA1MRGPRX4MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221210-A1 Thyroid Receptor Agonists KARO BIO AB (SE) 2008-09-11 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-20080221210-A1 Thyroid Receptor Agonists TSHR, TRHR, THRA ALDH1A1 1818/4885TRPA1 675/4885LMNA 3893/4885

“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.