SCHEMBL3392231

SCHEMBL3392231

COc1ccc(C(=O)Nc2cnc(Nc3ccc(C)cc3)s2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
RAB9A P51151 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MAPT P10636 3/20 0.55
NPC1 O15118 2/20 0.55
MAPK1 P28482 1/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 2/20 0.53
PTGER3 P43115 1/20 0.53
PKM P14618 2/20 0.51
ALDH1A1 P00352 2/20 0.51
FLT3 P36888 1/20 0.50
KDR P35968 1/20 0.50
TP53 P04637 1/20 0.49
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PDE4D Q08499 1/20 0.48
NQO2 P16083 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
SCHEMBL3398555 0.82 RAB9A (0.55) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL3397155 0.82 CSNK2A2 (0.60) MEN1KMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL3394845 0.81 MEN1 (0.57) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL17664663 0.80 MEN1 (0.72) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL3398669 0.79 CSNK2A2 (0.49) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL2367572 0.78 TNIK (0.70) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL3393588 0.77 CSNK2A2 (0.55) KMT2ARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3390828 0.77 MEN1 (0.56) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL3394933 0.77 CSNK2A2 (0.60) MEN1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL3397171 0.76 MAPK13 (0.69) MEN1KMT2ARAB9ASMN1; SMN2NPC1

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 MEN1 3798/4885KMT2A 831/4885RAB9A 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.