SCHEMBL8738463

SCHEMBL8738463

Cc1nc(-c2cnccn2)sc1-c1csc(Nc2cc(C(N)=O)ccc2OC(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 13/20 0.43
KMT2A Q03164 13/20 0.43
MAPT P10636 12/20 0.43
GAA P10253 7/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
ALDH1A1 P00352 9/20 0.43
KDM4E B2RXH2 7/20 0.43
HTT P42858 5/20 0.43
ALOX12 P18054 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
HPGD P15428 4/20 0.43
CFTR P13569 4/20 0.43
LMNA P02545 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
ALB P02768 1/20 0.43
HSD17B10 Q99714 1/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL8737954 0.89 MEN1 (0.48) MEN1KMT2AMAPTGAACYP3A4
SCHEMBL8738035 0.89 MEN1 (0.45) MEN1KMT2AMAPTGAACYP3A4
SCHEMBL8738489 0.85 PIK3CG (0.60) MEN1KMT2AMAPTGAACYP3A4
SCHEMBL8738028 0.85 MEN1 (0.56) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL6114193 0.85 MEN1 (0.58) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL8738338 0.84 TRPV4 (0.52) MEN1KMT2AMAPTGAACYP3A4
Bromide SCHEMBL6113998 0.84 MEN1 (0.57) MEN1KMT2AMAPTGAAALDH1A1
Bromide SCHEMBL6113988 0.84 MEN1 (0.56) MEN1KMT2AMAPTGAAALDH1A1
SCHEMBL6113997 0.82 TDP1 (0.48) MEN1KMT2AMAPTGAACYP3A4
SCHEMBL8738335 0.82 MAPT (0.55) MEN1KMT2AMAPTGAACYP3A4

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
WO-2012068209-A2 BISTHIAZOLE INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION JANSSEN PHARMACEUTICA NV (BE) 2012-05-24 WO disclosed
US-20120129842-A1 BISTHIAZOLE INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION JANSSEN PHARMACEUTICA N.V. (BE) 2012-05-24 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-20120129842-A1 BISTHIAZOLE INHIBITORS OF PRO-MATRIX METALLOPROTEINASE ACTIVATION MMP1, MMP9, MMP2 MEN1 2298/4885KMT2A 2435/4885MAPT 3531/4885

“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.