SCHEMBL14947386

SCHEMBL14947386

N=CCN(C(=O)Cc1ccc(Cl)cc1)c1cc(-c2ccccc2)sc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.39
PTPRA P18433 1/20 0.39
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
PTPRF P10586 1/20 0.36
ACLY P53396 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL2157689 0.91 PTPN1 (0.38) PTPN1PTPRATP53MAPT
SCHEMBL2158591 0.81 IGF2BP2 (0.39) PTPN1MAPT
SCHEMBL2157664 0.79 MAPT (0.38) PTPN1MAPTPTPRF
SCHEMBL2157508 0.78 TSHR (0.48) PTPN1TP53MAPT
SCHEMBL2157378 0.78 ERCC1 (0.39)
SCHEMBL2252385 0.78 LTB4R2 (0.43) MAPT
SCHEMBL2456970 0.78 MAPT (0.42) PTPN1PTPRAMAPT
SCHEMBL2157850 0.78 TACR1 (0.38)
SCHEMBL3811288 0.77 MC4R (0.40) PTPN1PTPRF
SCHEMBL3811130 0.77 LTB4R2 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130123242-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS (CANADA) INCORPORATED (CA) 2013-05-16 US disclosed
US-20130123242-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS VERTEX PHARMACEUTICALS (CANADA) INCORPORATED (CA) 2013-05-16 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-20130123242-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OR PREVENTION OF FLAVIVIRUS INFECTIONS HAVCR2, ZC3HAV1, MAVS PTPN1 1592/4885PTPRA 2547/4885TP53 4233/4885

“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.