SCHEMBL6001908

SCHEMBL6001908

c1csc(-c2cc(Nc3ccc4c(c3)OCO4)c3ccccc3n2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.49
KDM1A O60341 1/20 0.48
TGFBR1 P36897 1/20 0.48
MAPT P10636 3/20 0.47
GAA P10253 3/20 0.47
ACP1 P24666 1/20 0.47
POLB P06746 1/20 0.46
RPS6KB2 Q9UBS0 1/20 0.46
EGFR P00533 1/20 0.46
HSD17B10 Q99714 4/20 0.46
ALOX15 P16050 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
CASP1 P29466 2/20 0.45

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
SCHEMBL6001182 0.81 HSD17B10 (0.49) PTGS2KDM1ATGFBR1MAPTGAA
SCHEMBL6001380 0.80 PDE5A (0.67) KDM1ATGFBR1MAPTGAAHSD17B10
SCHEMBL6001965 0.79 ACP1 (0.61) PTGS2TGFBR1MAPTACP1POLB
SCHEMBL5999866 0.74 ABCB1 (0.55) MAPTACP1POLBMEN1KMT2A
SCHEMBL23052940 0.73 MEN1 (0.59) MAPTGAAACP1POLBHSD17B10
SCHEMBL13888984 0.73 KDM1A (0.84) PTGS2KDM1ATGFBR1MAPTGAA
SCHEMBL1920761 0.69 NPC1 (0.54) PTGS2MAPTGAAPOLBEGFR
SCHEMBL3114780 0.69 TGFBR1 (0.62) KDM1ATGFBR1MAPTGAAEGFR
SCHEMBL29230441 0.68 KDM1A (0.52) PTGS2KDM1ATGFBR1MAPTGAA
SCHEMBL6001405 0.68 SMN1; SMN2 (0.57) MAPTGAARPS6KB2HSD17B10ALOX15

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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods REDDY US THERAPEUTICS, INC. 2006-06-15 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-20060128702-A1 Heterocyclic and bicyclic compounds, compositions and methods HPSE, ENGASE, UGCG PTGS2 223/4885KDM1A 2478/4885TGFBR1 2427/4885

“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.