SCHEMBL3498715

SCHEMBL3498715

CCOC(=O)c1cc2cc(-c3cccnc3)ccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.59
MMP13 P45452 1/20 0.59
MMP14 P50281 1/20 0.59
CDC7 O00311 3/20 0.51
DBF4 Q9UBU7 3/20 0.51
CYP11B1 P15538 4/20 0.49
CYP11B2 P19099 4/20 0.49
CYP19A1 P11511 3/20 0.49
F9 P00740 1/20 0.48
F10 P00742 1/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
POLB P06746 1/20 0.48
NFKB1 P19838 1/20 0.48
RAB9A P51151 1/20 0.48
NFKB2 Q00653 1/20 0.48
KMT2A Q03164 1/20 0.48
RELA Q04206 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
SCHEMBL9431623 0.87 CYP11B2 (0.62) MMP2MMP13MMP14CYP11B1CYP11B2
SCHEMBL3500033 0.81 MAPT (0.56) MMP2MMP13MMP14F9F10
SCHEMBL3499177 0.81 MKNK1 (0.55) CYP11B1CYP11B2CYP19A1F9MKNK1
SCHEMBL19964502 0.80 CHEK1 (0.57) CYP11B1CYP11B2CYP19A1F9MKNK1
SCHEMBL11070341 0.80 CDC7 (0.53) CDC7DBF4KDM4EMAPTNPC1
SCHEMBL3498021 0.79 MAPT (0.50) F9F10KDM4EMAPTALDH1A1
SCHEMBL3498454 0.79 MAPK14 (0.54) F9F10KDM4EMAPTNPC1
SCHEMBL3498640 0.78 MAPT (0.52) F9F10KDM4EMAPTMEN1
SCHEMBL5487018 0.78 CYP11B2 (0.74) MMP2MMP13MMP14CYP11B1CYP11B2
SCHEMBL842776 0.77 GSK3B (0.60) CDC7DBF4MAPTALDH1A1PKM

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-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 MMP2 3984/4885MMP13 3858/4885MMP14 2821/4885

“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.