SCHEMBL5423313

SCHEMBL5423313

Cc1ccc(Br)cc1SCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP1A2 P05177 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MCL1 Q07820 2/20 0.41
GRK6 P43250 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
BCAT2 O15382 1/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 2/20 0.40
CYP3A4 P08684 1/20 0.40
FFAR1 O14842 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.40
TDP2 O95551 1/20 0.40
NSD2 O96028 1/20 0.40

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
SCHEMBL5416075 0.85 PKM (0.43) PKMMAPTGAATDP1CYP1A2
SCHEMBL31709319 0.82 L3MBTL1 (0.57) PKMMAPTTDP1CYP1A2L3MBTL1
SCHEMBL4413652 0.82 L3MBTL1 (0.57) PKMMAPTTDP1CYP1A2L3MBTL1
SCHEMBL20448299 0.79 PTPRC (0.50) MAPTGAATDP1CYP1A2MCL1
SCHEMBL11091002 0.79 ALDH1A1 (0.54) MAPTGAATDP1CYP1A2L3MBTL1
SCHEMBL5416197 0.79 ALDH1A1 (0.44) PKMMAPTTDP1L3MBTL1ALDH1A1
SCHEMBL29093342 0.76 CYP1A2 (0.46) MAPTGAATDP1CYP1A2MCL1
SCHEMBL1660158 0.74 CYP1A2 (0.61) MAPTGAATDP1CYP1A2NPC1
SCHEMBL18791153 0.72 POLB (0.46) PKMMAPTTDP1L3MBTL1NPC1
SCHEMBL14273069 0.71 LMNA (0.56) MAPTTDP1CYP1A2L3MBTL1MCL1

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-20070276030-A1 Pyranobenzothiophene derivatives to treat infection with hepatitis c virus WYETH (US) 2007-11-29 US disclosed
WO-2005016932-A1 PYRANOBENZOTHIOPHENE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2005-02-24 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-20070276030-A1 Pyranobenzothiophene derivatives to treat infection with hepatitis c virus LIPC, HAVCR2, GTF3C2 PKM 1748/4885MAPT 2889/4885GAA 3674/4885

“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.