SCHEMBL2998571

SCHEMBL2998571

CN1CCN(Cc2c(C(=O)O)sc3c(-c4ccccc4)c(-c4ccc(Cl)cc4)n(C)c23)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.49
TACR1 P25103 1/20 0.40
F2 P00734 4/20 0.39
F10 P00742 4/20 0.39
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC2A1 P11166 1/20 0.39
CHKA P35790 1/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.38
BCL2 P10415 1/20 0.37
KDM4E B2RXH2 1/20 0.37
KLK7 P49862 1/20 0.37
MDM2 Q00987 1/20 0.37
MC4R P32245 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36

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
SCHEMBL3001007 0.93 BCL2L1 (0.41) BCL2L1TACR1ALDH1A1MEN1KMT2A
SCHEMBL2996692 0.90 BCL2L1 (0.41) BCL2L1TACR1TP53MDM2HDAC1
SCHEMBL2997421 0.90 BCL2L1 (0.40) BCL2L1TACR1ALDH1A1MEN1KMT2A
SCHEMBL2990716 0.83 EGFR (0.43) BCL2L1TACR1TP53KDM4EMDM2
SCHEMBL2997214 0.82 BCL2L1 (0.37) BCL2L1F2F10ALDH1A1MEN1
SCHEMBL2998567 0.81 TACR1 (0.37) BCL2L1TACR1F2F10ADORA1
SCHEMBL2999634 0.76 AKT1 (0.36) BCL2L1TACR1ALDH1A1SMN1; SMN2TP53
SCHEMBL3001005 0.76 MEN1 (0.36) TACR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL2996688 0.75 MMP2 (0.35) BCL2L1TACR1
SCHEMBL2995608 0.75 EGFR (0.44) TP53KDM4EMDM2

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 10 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 claimed
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 US claimed
EP-1664059-B1 THIENOPYRROLES AS ANTIVIRAL AGENTS ANGELETTI P IST RICHERCHE BIO (IT) 2007-09-12 EP claimed
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
US-7781431-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2010-08-24 US disclosed
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
US-20090036443-A1 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI (IT) 2009-02-05 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

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 BCL2L1 3784/4885TACR1 763/4885F2 653/4885

“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.