SCHEMBL14947250

SCHEMBL14947250

COC(=O)c1sc(-c2ccccc2)cc1NCc1ccc(-c2cccc(F)c2)o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.58
▸ KDM4E B2RXH2 5/20 0.53
▸ MAPT P10636 9/20 0.53
▸ TP53 P04637 2/20 0.53
▸ ALDH1A1 P00352 3/20 0.52
▸ LMNA P02545 2/20 0.52
▸ HPGD P15428 4/20 0.50
▸ HTT P42858 2/20 0.47
▸ ATM Q13315 1/20 0.47
▸ NR4A1 P22736 1/20 0.46
▸ NR4A2 P43354 1/20 0.46
▸ NR4A3 Q92570 1/20 0.46
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ IKBKB O14920 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PLA2G1B P04054 1/20 0.41
▸ ATG4B Q9Y4P1 1/20 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
SCHEMBL12357238 0.87 KDM4E (0.49) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL2157913 0.77 ALDH1A1 (0.47) POLBKDM4EMAPTALDH1A1HPGD
SCHEMBL1406017 0.75 POLB (0.71) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL13715912 0.74 MAPT (0.50) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL2879066 0.73 KDM4E (0.60) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL2879296 0.73 POLB (0.61) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL2157496 0.72 MAPT (0.76) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL23451959 0.72 KDM4E (0.57) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL2158421 0.72 HPGD (0.67) POLBKDM4EMAPTTP53ALDH1A1
SCHEMBL4949353 0.71 NR4A1 (0.70) KDM4EALDH1A1HPGDHTTNR4A1

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-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 POLB 2949/4885KDM4E 3220/4885MAPT 1458/4885

“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.

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