SCHEMBL11949643

SCHEMBL11949643

O=C(Nc1ccncc1)C1CCC(Cn2cnc3ccccc3c2=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.51
▸ TNKS O95271 6/20 0.51
▸ TNKS2 Q9H2K2 6/20 0.51
▸ HTT P42858 2/20 0.47
▸ LMNA P02545 2/20 0.46
▸ POLB P06746 2/20 0.45
▸ GLA P06280 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ROCK2 O75116 1/20 0.44
▸ ROCK1 Q13464 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CHKA P35790 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11949642 0.88 MAPT (0.53) MAPTHTTLMNAPOLBTDP1
SCHEMBL11949640 0.88 MAPT (0.47) MAPTHTTPOLBTP53MEN1
SCHEMBL11949645 0.87 MAPT (0.52) MAPTHTTPOLBTDP1MEN1
SCHEMBL11949649 0.84 GCK (0.56) MAPTHTTLMNATDP1MEN1
SCHEMBL11949735 0.81 SMN1; SMN2 (0.54) MAPTHTTPOLBTDP1MEN1
SCHEMBL11949648 0.81 MAPT (0.58) MAPTHTTPOLBTDP1GAA
SCHEMBL11949639 0.81 RAB9A (0.50) MAPTHTTLMNAPOLBKMT2A
SCHEMBL11949637 0.81 KDM4E (0.66) MAPTHTTLMNAPOLBTP53
SCHEMBL11949650 0.81 SMN1; SMN2 (0.62) MAPTHTTLMNAPOLBTDP1
SCHEMBL11949653 0.81 MAPT (0.50) MAPTHTTLMNAPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865704-B2 Wnt pathway antagonists SIENA BIOTECH S.P.A. (IT) 2014-10-21 — — US disclosed
US-8865704-B2 Wnt pathway antagonists SIENA BIOTECH S.P.A. (IT) 2014-10-21 — — US disclosed
US-20120196851-A1 WNT PATHWAY ANTAGONISTS SIENA BIOTECH S.P.A. (IT) 2012-08-02 — — US disclosed
US-20120196851-A1 WNT PATHWAY ANTAGONISTS SIENA BIOTECH S.P.A. (IT) 2012-08-02 — — 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-20120196851-A1 WNT PATHWAY ANTAGONISTS WNT1, WNT3A, CTNNB1 MAPT 4418/4885TNKS 562/4885TNKS2 489/4885

“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.

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