SCHEMBL10069115

SCHEMBL10069115

O=C(CO/N=C/c1ccc(Cl)cc1Cl)NNC(=S)Nc1cc(Cl)ccc1Cl

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TASP1 Q9H6P5 1/20 0.73
GAA P10253 5/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 8/20 0.46
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
POLB P06746 3/20 0.46
EPHX1 P07099 2/20 0.45
ALOX12 P18054 2/20 0.43
IDO1 P14902 1/20 0.43
HPGD P15428 3/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
THRB P10828 2/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 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
SCHEMBL10069516 0.85 TASP1 (1.00) TASP1GAAMAPTALDH1A1MEN1
SCHEMBL21972742 0.72 ALDH1A1 (0.54) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL11535253 0.70 EPHX1 (0.75) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL3108173 0.67 POLB (0.55) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL3108196 0.67 POLB (0.55) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL11199924 0.67 TDP1 (0.46) TASP1MAPTALDH1A1MEN1KMT2A
SCHEMBL11199920 0.67 TDP1 (0.46) TASP1MAPTALDH1A1MEN1KMT2A
SCHEMBL4309823 0.66 MAPT (0.49) TASP1GAAMAPTALDH1A1KMT2A
SCHEMBL5179639 0.65 KMT2A (0.63) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL11887603 0.65 NPC1 (0.65) MAPTALDH1A1MEN1KMT2AALOX12

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-8501811-B2 TASPASE1 inhibitors and their uses WASHINGTON UNIVERSITY (US) 2013-08-06 US disclosed
US-20120015990-A1 TASPASE1 INHIBITORS AND THEIR USES THE WASHINGTON UNIVERSITY (US) 2012-01-19 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-20120015990-A1 TASPASE1 INHIBITORS AND THEIR USES RNASE1, TASP1, PPA1 TASP1 2/4885GAA 12/4885MAPT 4457/4885

“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.