SCHEMBL26577804

SCHEMBL26577804

CCc1cc(OC)c2ncc(Br)cc2c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.44
MAPT P10636 4/20 0.40
NPSR1 Q6W5P4 3/20 0.40
ALDH1A1 P00352 2/20 0.40
PRNP P04156 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NQO2 P16083 4/20 0.36
PKM P14618 1/20 0.35
HPGDS O60760 1/20 0.33
KMT2A Q03164 1/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
ALOX12 P18054 1/20 0.33
RAB9A P51151 1/20 0.33
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL14904002 0.86 HSD17B10 (0.43) MAPTNPSR1ALDH1A1PRNPRXFP1
SCHEMBL23904742 0.81 PTGS2 (0.41) PTGS2ALDH1A1HPGDS
SCHEMBL12074836 0.79 ALDH1A1 (0.42) MAPTNPSR1ALDH1A1PRNPRXFP1
SCHEMBL23958814 0.79 ALDH1A1 (0.46) MAPTNPSR1ALDH1A1PRNPRXFP1
SCHEMBL23905307 0.78 PTGS2 (0.41) PTGS2MAPTNPSR1ALDH1A1KMT2A
SCHEMBL23904823 0.76 HSD17B2 (0.47) MAPTHPGDSKMT2ANPC1GAA
SCHEMBL26762020 0.75 ALDH1A1 (0.40) MAPTNPSR1ALDH1A1PRNPRXFP1
SCHEMBL26563693 0.75 ALDH1A1 (0.46) PTGS2MAPTNPSR1ALDH1A1PRNP
SCHEMBL23883090 0.75 ALDH1A1 (0.45) MAPTNPSR1ALDH1A1PRNPRXFP1
SCHEMBL20675605 0.73 MEN1 (0.49) PTGS2MAPTALDH1A1KMT2ANPC1

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-20230357258-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARMACEUTICALS, INC. 2023-11-09 US disclosed
WO-2023196454-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARMACEUTICALS, INC. (US) 2023-10-12 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-20230357258-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ACE, HPRT1, ACE2 PTGS2 1219/4885MAPT 4609/4885NPSR1 890/4885

“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.