SCHEMBL5652363

SCHEMBL5652363

CCOCCCn1c(=S)[nH]c2cc(C(=O)O)ccc2c1=O

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.76
▸ MAPT P10636 2/20 0.76
▸ ALDH1A1 P00352 7/20 0.74
▸ HPGD P15428 3/20 0.74
▸ TSHR P16473 2/20 0.74
▸ RECQL P46063 2/20 0.74
▸ RXFP1 Q9HBX9 3/20 0.72
▸ GAA P10253 2/20 0.69
▸ KDM4E B2RXH2 3/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ HTT P42858 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ TAOK1 Q7L7X3 1/20 0.59
▸ TAOK3 Q9H2K8 1/20 0.59

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
SCHEMBL5655807 0.76 TAOK1 (1.00) SMN1; SMN2MAPTALDH1A1HPGDTSHR
SCHEMBL31730308 0.76 TAOK1 (1.00) SMN1; SMN2MAPTALDH1A1HPGDTSHR
SCHEMBL22281511 0.75 KMT2A (0.67) SMN1; SMN2MAPTALDH1A1TSHRGAA
SCHEMBL15613189 0.74 ALDH1A1 (1.00) SMN1; SMN2MAPTALDH1A1HPGDTSHR
SCHEMBL15613190 0.73 KDM4E (0.58) SMN1; SMN2ALDH1A1HPGDRXFP1GAA
SCHEMBL4251761 0.73 KDM4E (0.83) SMN1; SMN2MAPTALDH1A1HPGDGAA
SCHEMBL16872898 0.72 ALDH1A1 (0.80) SMN1; SMN2MAPTALDH1A1HPGDTSHR
SCHEMBL27202845 0.72 ALDH1A1 (0.74) SMN1; SMN2MAPTALDH1A1HPGDGAA
SCHEMBL19665251 0.72 MPO (0.67) SMN1; SMN2MAPTALDH1A1HPGDTSHR
SCHEMBL2917327 0.71 KMT2A (0.58) SMN1; SMN2ALDH1A1HPGDTSHRGAA

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-20070208166-A1 Tao Kinase Modulators And Method Of Use EXELIXIS, INC. (US) 2007-09-06 — — 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-20070208166-A1 Tao Kinase Modulators And Method Of Use TAOK1, TAOK3, MAP3K6 SMN1; SMN2 4552/4885MAPT 4207/4885ALDH1A1 4424/4885

“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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