SCHEMBL6941285

SCHEMBL6941285

CNCc1nc2cc3c(cc2[nH]1)COO3

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
KMT2A Q03164 3/20 0.34
GAA P10253 2/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
PSMD14 O00487 1/20 0.34
MMP2 P08253 1/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PDE10A Q9Y233 1/20 0.34
POLB P06746 1/20 0.33
CDC7 O00311 2/20 0.33
CCNE1 P24864 2/20 0.33
CDK2 P24941 2/20 0.33
ROCK1 Q13464 2/20 0.33
DBF4 Q9UBU7 2/20 0.33
CACNA1G O43497 2/20 0.33
CACNA1H O95180 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6941291 0.77 PDE10A (0.50) PKMKMT2AGAAHTTMEN1
SCHEMBL16188974 0.71 KMT2A (0.64) PKMKMT2AGAAHTTMEN1
SCHEMBL8325831 0.70 PKM (0.54) PKMKMT2AGAAHTTMEN1
SCHEMBL7332580 0.68 F10 (0.53) PKMKMT2AGAAHTTMEN1
SCHEMBL16188989 0.67 GAA (0.53) PKMKMT2AGAAHTTMEN1
SCHEMBL19494267 0.67 PKM (0.50) PKMKMT2AGAAHTTMEN1
SCHEMBL21486288 0.66 PKM (0.61) PKMKMT2AGAAHTTMEN1
SCHEMBL16188975 0.66 KMT2A (0.68) PKMKMT2AGAAHTTMEN1
SCHEMBL16188990 0.66 GAA (0.51) PKMKMT2AGAAHTTMEN1
SCHEMBL24376403 0.65 PKM (0.59) PKMKMT2AGAAHTTMEN1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946180-A4 METHOD FOR STIMULATING BONE FORMATION SMITHKLINE BEECHAM CORP (US) 2003-07-23 EP disclosed
EP-0767792-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2002-11-20 EP disclosed
US-20020032187-A1 Method for stimulating bone formation SMITHKLINE BEECHAM CORPORATION 2002-03-14 US disclosed
US-5977101-A Benzimidazoles/Imidazoles Linked to a Fibrinogen Receptor Antagonist Template Having Vitronectin Receptor Antagonist Activity SMITHKLINE BEECHAM CORPORATION (US) 1999-11-02 US disclosed
EP-0946180-A1 METHOD FOR STIMULATING BONE FORMATION SMITHKLINE BEECHAM CORPORATION (US) 1999-10-06 EP disclosed
WO-1998015278-A1 METHOD FOR STIMULATING BONE FORMATION SMITHKLINE BEECHAM CORPORATION (US) 1998-04-16 WO disclosed
EP-0767792-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-04-16 EP disclosed
WO-1996000730-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1996-01-11 WO 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-20020032187-A1 Method for stimulating bone formation BMP2, BMP4, SOST PKM 4426/4885KMT2A 4771/4885GAA 3216/4885

“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.