SCHEMBL4803017

SCHEMBL4803017

COc1ccc(-c2nc3cc(F)ccc3s2)cc1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.79
MAPT P10636 6/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
KDM4E B2RXH2 4/20 0.70
TP53 P04637 4/20 0.70
ALDH1A1 P00352 3/20 0.70
NPC1 O15118 3/20 0.70
KMT2A Q03164 3/20 0.70
HPGD P15428 2/20 0.70
MEN1 O00255 2/20 0.70
BLM P54132 2/20 0.70
HCRTR1 O43613 1/20 0.70
MAPK1 P28482 1/20 0.70
NPSR1 Q6W5P4 1/20 0.70
HSD17B10 Q99714 1/20 0.70
RAB9A P51151 2/20 0.56
GLA P06280 2/20 0.56
GAA P10253 1/20 0.56
PPARG P37231 1/20 0.56
NCOA2 Q15596 1/20 0.56

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
SCHEMBL4803129 0.90 AHR (0.79) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL30307425 0.88 AHR (1.00) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL30288215 0.88 AHR (1.00) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL4797786 0.88 AHR (1.00) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL25877004 0.87 AHR (0.70) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL4807691 0.87 AHR (0.82) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL4797737 0.86 AHR (0.81) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL25876975 0.85 AHR (0.67) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL4803564 0.85 AHR (0.79) AHRMAPTSMN1; SMN2KDM4ETP53
SCHEMBL4803066 0.85 AHR (0.79) AHRMAPTSMN1; SMN2KDM4ETP53

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-7384966-B2 2-arylbenzothiazole derivatives PHARMINXO LIMITED (GB) 2008-06-10 US disclosed
US-20060063816-A1 2-Arylbenzothiazole derivatives STEVENS MALCOLM F G 2006-03-23 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-20060063816-A1 2-Arylbenzothiazole derivatives CX3CR1, HCN2, CYBB AHR 60/4885MAPT 4559/4885SMN1; SMN2 3362/4885

“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.