SCHEMBL2995418

SCHEMBL2995418

CCOC(=O)c1cc(NC(C)=O)cs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 1/20 0.49
ALOX15 P16050 1/20 0.49
MMP13 P45452 1/20 0.46
ALDH1A1 P00352 5/20 0.44
POLB P06746 2/20 0.43
TP53 P04637 1/20 0.43
HPGD P15428 3/20 0.42
TSHR P16473 2/20 0.42
MAPT P10636 2/20 0.42
CTPS1 P17812 1/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
GALR2 O43603 1/20 0.42
MITF O75030 1/20 0.42
HSP90AA1 P07900 1/20 0.42
XBP1 P17861 1/20 0.42
CCR6 P51684 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP1A2 P05177 2/20 0.41
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL2988623 0.81 LEF1 (0.47) PRKCZHPGDCTPS1SMN1; SMN2CYP1A2
SCHEMBL17900447 0.79 HPGD (0.56) MMP13ALDH1A1POLBTP53HPGD
SCHEMBL9430177 0.78 MAPT (0.50) ALDH1A1TP53HPGDTSHRMAPT
SCHEMBL6826976 0.76 DAO (0.57) ALDH1A1POLBHPGDTSHRMAPT
SCHEMBL28490756 0.76 DAO (0.52) ALDH1A1POLBTSHRMAPTCTPS1
SCHEMBL11183836 0.76 LMNA (0.41) ALDH1A1HPGDTSHRLMNASMN1; SMN2
SCHEMBL6030268 0.75 CA12 (0.52) ALDH1A1HPGDMAPTLMNACYP1A2
SCHEMBL160967 0.75 CA12 (0.43) ALDH1A1POLBHPGDTSHRMAPT
SCHEMBL13469125 0.75 MAPT (0.47) ALDH1A1HPGDTSHRMAPTSMN1; SMN2
SCHEMBL9372373 0.75 CA12 (0.52) ALDH1A1HPGDTSHRMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US disclosed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP disclosed
EP-1664059-A1 THIENOPYRROLES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-06-07 EP disclosed
WO-2005023819-A9 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2006-03-23 WO disclosed
WO-2005023819-A1 THIENOPYRROLES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2005-03-17 WO 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-20090036443-A1 Thienopyrroles as antiviral agents ZC3HAV1, XDH, TPMT PRKCZ 2762/4885ALOX15 1831/4885MMP13 4827/4885

“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.