SCHEMBL4092445

SCHEMBL4092445

Cc1csc(-c2cc3cc(C(=O)O)n(-c4ccc(OC(C)C)cc4)c3s2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.46
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MCL1 Q07820 6/20 0.34
BCL2 P10415 3/20 0.34
MDM2 Q00987 3/20 0.34
HPGD P15428 1/20 0.32
THRB P10828 1/20 0.32
TSHR P16473 1/20 0.32
IDH1 O75874 1/20 0.31
PARP10 Q53GL7 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
TSPO P30536 1/20 0.31

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
SCHEMBL4092023 0.85 PTGES (0.48) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL4103994 0.85 PTGES (0.56) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL4105667 0.69 PTGES (0.48) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL4924661 0.69 PTGES (0.67) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL5319595 0.69 PTGES (0.67) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL3574806 0.69 PTGES (0.85) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL3574822 0.69 PTGES (0.71) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL4097942 0.68 PTGES (0.57) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL4918706 0.66 PTGES (0.64) PTGESKMT2AALDH1A1MCL1BCL2
SCHEMBL3579996 0.65 PTGES (0.78) PTGESKMT2AALDH1A1MCL1BCL2

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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2009-03-12 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-20090069384-A1 THIENOPYRROLES USEFUL IN THE TREATMENT OF INFLAMMATION NPY5R, TH, PTGES PTGES 3/4885KMT2A 4308/4885ALDH1A1 2718/4885

“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.