SCHEMBL30770982

SCHEMBL30770982

CCOC(=O)C(C)(C)Cc1c(C(=O)CC(C)(C)C)c2cc(OC(=O)CC(C)(C)C)ccc2n1Cc1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 11/20 0.58
PTGES O14684 3/20 0.58
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
ALOX5AP P20292 8/20 0.50
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALOX5 P09917 2/20 0.44

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
SCHEMBL23270776 1.00 PTGES2 (0.58) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL9288153 0.91 PTGES2 (0.60) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL23641032 0.91 PTGES2 (0.60) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL25970457 0.86 PTGES2 (0.51) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL23270745 0.85 PTGES2 (0.80) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL23270813 0.83 PTGES2 (0.62) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL30181343 0.83 PTGES2 (0.62) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL23641194 0.82 PTGES2 (0.58) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL25968363 0.82 PTGES2 (0.64) PTGES2PTGESPTGS1PTGS2ALOX5AP
SCHEMBL30181215 0.81 PTGES2 (0.73) PTGES2PTGESPTGS1PTGS2ALOX5AP

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-20240043423-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HEDGEHOG PATHWAY ASSOCIATED CONDITIONS SUZHOU MEDNES PHARMA TECH CO., LTD. (CN) 2024-02-08 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-20240043423-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HEDGEHOG PATHWAY ASSOCIATED CONDITIONS SHH, GLI1, SMO PTGES2 1476/4885PTGES 1752/4885PTGS1 583/4885

“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.