SCHEMBL4576358

SCHEMBL4576358

COc1cc(Cc2cnc(N)nc2N)c2cc(C(O)c3c(C(=O)N(C)C)[nH]c4ccc(Cl)cc34)oc2c1OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
DHFR P00374 2/20 0.37
MEN1 O00255 1/20 0.37
SLC22A1 O15245 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
CYP2C19 P33261 1/20 0.37
BLM P54132 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
P2RX3 P56373 2/20 0.36
P2RX2 Q9UBL9 2/20 0.36

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
SCHEMBL14140131 0.92 SMN1; SMN2 (0.42) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL30932949 0.87 SMN1; SMN2 (0.39) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL3258035 0.87 SMN1; SMN2 (0.39) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL4576056 0.85 SMN1; SMN2 (0.41) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL3250064 0.82 SMN1; SMN2 (0.38) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL5657657 0.81 DHFR (0.47) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL14140118 0.80 SMN1; SMN2 (0.40) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL6003796 0.80 SMN1; SMN2 (0.38) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL3255329 0.79 SMN1; SMN2 (0.40) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1
SCHEMBL14140130 0.79 SMN1; SMN2 (0.41) SMN1; SMN2DHFRMEN1SLC22A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161561-A1 Novel Processing for the Preparation of a Benzofuran ARPIDA (CH) 2008-07-03 US disclosed
US-20080161561-A1 Novel Processing for the Preparation of a Benzofuran ARPIDA (CH) 2008-07-03 US disclosed
US-20080161561-A1 Novel Processing for the Preparation of a Benzofuran ARPIDA (CH) 2008-07-03 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-20080161561-A1 Novel Processing for the Preparation of a Benzofuran DHFR, DHPS, DPYD SMN1; SMN2 2926/4885DHFR 1/4885MEN1 3217/4885

“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.