SCHEMBL6448799

SCHEMBL6448799

Oc1ccc(O)c(-c2nc(-c3ncccc3-c3ccccc3)no2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.53
SENP8 Q96LD8 2/20 0.53
SENP7 Q9BQF6 2/20 0.53
SENP6 Q9GZR1 2/20 0.53
CHUK O15111 2/20 0.53
TXNRD1 Q16881 2/20 0.53
NOX4 Q9NPH5 2/20 0.53
GPR55 Q9Y2T6 1/20 0.47
MAPT P10636 7/20 0.46
ALDH1A1 P00352 6/20 0.46
TSHR P16473 5/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 7/20 0.45
HTT P42858 1/20 0.45
KDM6B O15054 1/20 0.41
KDM6A O15550 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSD17B10 Q99714 6/20 0.41
MAPK1 P28482 4/20 0.41
RAB9A P51151 6/20 0.41

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
SCHEMBL6452100 0.91 CASP3 (0.51) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6451920 0.88 CASP3 (0.51) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6452697 0.82 NPC1 (0.45) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6454743 0.81 NPC1 (0.56) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6453920 0.80 GAA (0.52) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6452338 0.79 MAPT (0.57) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6449624 0.79 S1PR1 (0.50) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6452382 0.79 SMN1; SMN2 (0.47) CASP3SENP8SENP7SENP6CHUK
SCHEMBL6454119 0.78 SMN1; SMN2 (0.58) MAPTALDH1A1TSHRPOLBSMN1; SMN2
SCHEMBL6452064 0.78 MAPK1 (0.43) CASP3SENP8SENP7SENP6MAPT

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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2005-04-07 US disclosed
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 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-20050075375-A1 Heterocyclic compounds for treating hepatitis C virus HAVCR2, HCCS, LIPC CASP3 330/4885SENP8 1825/4885SENP7 1895/4885

“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.