SCHEMBL3393588

SCHEMBL3393588

COc1ccc(Nc2ncc(NC(=O)c3ccc(NC(C)=O)cc3)s2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 3/20 0.55
CSNK2A1 P68400 3/20 0.55
RAB9A P51151 5/20 0.53
NPC1 O15118 4/20 0.53
TP53 P04637 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
ALOX15 P16050 1/20 0.53
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK13 O15264 1/20 0.49
MAPK12 P53778 1/20 0.49
MAPK11 Q15759 1/20 0.49
MAPK14 Q16539 1/20 0.49
CYP1A2 P05177 1/20 0.49
MAPK1 P28482 1/20 0.48

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
SCHEMBL3397155 0.94 CSNK2A2 (0.60) CSNK2A2CSNK2A1RAB9ANPC1TP53
SCHEMBL3394933 0.88 CSNK2A2 (0.60) CSNK2A2CSNK2A1RAB9ANPC1SMN1; SMN2
SCHEMBL3393872 0.88 CSNK2A2 (0.52) CSNK2A2CSNK2A1RAB9ANPC1TP53
SCHEMBL3396818 0.87 CSNK2A2 (0.56) CSNK2A2CSNK2A1RAB9ANPC1TP53
SCHEMBL3398555 0.87 RAB9A (0.55) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL3393541 0.87 CACNA1B (0.56) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL3396383 0.87 CSNK2A2 (0.55) CSNK2A2CSNK2A1RAB9ANPC1TP53
SCHEMBL3397270 0.86 PTPN11 (0.50) RAB9ANPC1POLBKMT2AMAPK13
SCHEMBL3398551 0.86 POLB (0.49) RAB9ANPC1TP53SMN1; SMN2POLB
SCHEMBL3397310 0.85 CSNK2A2 (0.56) CSNK2A2CSNK2A1RAB9ANPC1TP53

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-20100216795-A1 TNIK INHIBITOR AND THE USE YAMADA TESSHI 2010-08-26 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-20100216795-A1 TNIK INHIBITOR AND THE USE TNIK, TNNI3K, TNK1 CSNK2A2 18/4885CSNK2A1 24/4885RAB9A 1982/4885

“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.