SCHEMBL5194046

SCHEMBL5194046

O=C(CNc1nc(-c2ccccc2)sc1C(=O)O)c1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CDC7 O00311 3/20 0.42
▸ DBF4 Q9UBU7 3/20 0.42
▸ ERCC5 P28715 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ ALDH1A1 P00352 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMO Q99835 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL5195685 0.89 CYP1A2 (0.47) SMN1; SMN2CDC7DBF4ERCC5FEN1
SCHEMBL5196156 0.83 SMN1; SMN2 (0.49) SMN1; SMN2CDC7DBF4ALDH1A1MAPT
SCHEMBL2250633 0.75 PTPN1 (0.52) ALDH1A1MAPTNPSR1KDM4EPOLB
SCHEMBL13674702 0.72 KDM4E (0.46) CDC7DBF4MAPTNPC1KDM4E
SCHEMBL8823109 0.71 CDC7 (0.61) SMN1; SMN2CDC7DBF4ALDH1A1HPGD
SCHEMBL5551093 0.71 SMN1; SMN2 (0.58) SMN1; SMN2CDC7DBF4ALDH1A1MAPT
SCHEMBL5193171 0.71 DHODH (0.52) SMN1; SMN2ALDH1A1MAPTGAAHPGD
SCHEMBL3824433 0.70 CDC7 (0.55) SMN1; SMN2CDC7DBF4MAPTHPGD
SCHEMBL5193285 0.70 POLB (0.51) SMN1; SMN2CDC7DBF4ALDH1A1MAPT
SCHEMBL5195674 0.69 XDH (0.62) SMN1; SMN2ALDH1A1MAPTHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1321463-B1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC (CA) 2007-08-08 — — EP claimed
EP-1321463-B1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC (CA) 2007-08-08 — — EP disclosed
US-6936629-B2 Compounds and methods for the treatment or prevention of flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-08-30 — — US disclosed
US-20030199503-A1 Compounds and methods for the treatment of prevention of flavivirus infections SHIRE BIOCHEM INC. (CA) 2003-10-23 — — US disclosed
EP-1321463-A1 Thiazole derivatives and their use for the treatment or prevention of Flavivirus infections Shire Biochem Inc. (CA) 2003-06-25 — — 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-20030199503-A1 Compounds and methods for the treatment of prevention of flavivirus infections HAVCR2, ZC3HAV1, EIF2AK2 SMN1; SMN2 669/4885CDC7 4724/4885DBF4 2982/4885

“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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