SCHEMBL15469667

SCHEMBL15469667

CSc1cnc2ccc(OC(SC)C(=O)NC(C)(C)c3cc(C(F)(F)F)on3)cc2c1

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
F2 P00734 1/20 0.30
GLA P06280 1/20 0.30
HPGD P15428 1/20 0.30
SCN9A Q15858 1/20 0.30
HPGDS O60760 1/20 0.30

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
SCHEMBL15469671 0.91 ALDH1A1 (0.30) ALDH1A1F2GLAHPGD
SCHEMBL15469622 0.89 KMT2A (0.34) ALDH1A1F2GLAHPGDHPGDS
SCHEMBL15469643 0.88
SCHEMBL15469630 0.88 ALDH1A1 (0.33) ALDH1A1F2GLAHPGD
SCHEMBL15469664 0.86 RAB9A (0.32) ALDH1A1F2GLAHPGD
SCHEMBL15469661 0.85 RAB9A (0.34) ALDH1A1F2GLAHPGD
SCHEMBL12966792 0.81 ALDH1A1 (0.33) ALDH1A1F2GLAHPGDSCN9A
SCHEMBL12181854 0.79 ALDH1A1 (0.37) ALDH1A1F2GLAHPGDSCN9A
SCHEMBL15469631 0.79 ALDH1A1 (0.31) ALDH1A1F2GLAHPGD
SCHEMBL15469672 0.79 KMT2A (0.34) ALDH1A1F2GLAHPGD

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-20140045890-A1 NOVEL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-13 US disclosed
US-20140045890-A1 NOVEL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-02-13 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-20140045890-A1 NOVEL COMPOUNDS CYP1B1, CYP1A1, CYP51A1 ALDH1A1 248/4885F2 3735/4885GLA 1020/4885

“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.