SCHEMBL2547871

SCHEMBL2547871

CN1CCCN(CC(=O)Nc2nc3cc(F)c(Sc4cnc5ncccn45)cc3s2)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PIK3CA P42336 1/20 0.40
CLK1 P49759 1/20 0.40
KDM4E B2RXH2 1/20 0.38
SLC27A1 Q6PCB7 1/20 0.38
GSK3B P49841 1/20 0.38
DYRK1A Q13627 1/20 0.38

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
SCHEMBL2539010 0.93 CLK1 (0.47) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2540214 0.90 USP2 (0.40) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2548141 0.90 ACHE (0.43) ALDH1A1POLBLMNASMN1; SMN2
SCHEMBL2540218 0.90 USP2 (0.41) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2546284 0.89 ALDH1A1 (0.42) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2538982 0.89 USP2 (0.40) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2543264 0.89 USP2 (0.40) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2547142 0.89 USP2 (0.42) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL3230611 0.89 USP2 (0.40) ALDH1A1POLBTSHRUSP2LMNA
SCHEMBL2543731 0.88 USP2 (0.39) ALDH1A1POLBTSHRUSP2LMNA

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-20110263593-A1 NOVEL IMIDAZO[1,2-a]PYRIMIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE, IN PARTICULAR AS MET INHIBITORS SANOFI-AVENTIS (FR) 2011-10-27 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-20110263593-A1 NOVEL IMIDAZO[1,2-a]PYRIMIDINE DERIVATIVES, METHOD FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE, IN PARTICULAR AS MET INHIBITORS TPMT, MET, PAICS ALDH1A1 250/4885POLB 1483/4885TSHR 2489/4885

“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.