SCHEMBL13620071

SCHEMBL13620071

CCC(C)NC(=S)NC(=O)C(C)(C)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.51
HTT P42858 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
ALPL P05186 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 5/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
STAT3 P40763 1/20 0.43
NPC1 O15118 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX12 P18054 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 3/20 0.41
EPHX2 P34913 2/20 0.41
MAPT P10636 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
SCHEMBL2605851 0.85 ALDH1A1 (0.54) GAAHTTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL169872 0.79 KMT2A (0.47) GAAHTTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL13619974 0.74 ALDH1A1 (0.48) GAAHTTL3MBTL1ALPLSMN1; SMN2
SCHEMBL17993491 0.73 MAPT (0.58) HTTSMN1; SMN2ALDH1A1RAB9AKMT2A
SCHEMBL27405464 0.73 MAPT (0.52) KMT2ACYP1A2CYP2C19KDM4EMAPT
SCHEMBL24571813 0.70 HDAC3 (0.50) SMN1; SMN2KMT2ACYP1A2CYP2C19KDM4E
SCHEMBL11283059 0.70 STAT3 (0.61) GAAHTTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL20077095 0.70 MAPT (0.52) HTTL3MBTL1ALDH1A1RAB9AKMT2A
SCHEMBL26127385 0.69 HTT (0.57) GAAHTTL3MBTL1ALPLSMN1; SMN2
SCHEMBL1897720 0.68 KMT2A (0.63) GAAHTTL3MBTL1SMN1; SMN2ALDH1A1

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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 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 (2 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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 GAA 2409/4885HTT 2476/4885L3MBTL1 3216/4885
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET GAA 764/4885HTT 566/4885L3MBTL1 3690/4885

“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.