SCHEMBL4872723

SCHEMBL4872723

O=C(Cn1c(-c2ccc3nc(-c4c(F)cccc4F)ccc3c2)c(-c2ccccc2)c2sc(C(=O)O)cc21)Nc1nccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 2/20 0.40
SIRT2 Q8IXJ6 1/20 0.39
PKM P14618 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 7/20 0.37
MEN1 O00255 6/20 0.37
HTT P42858 2/20 0.37
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP2C9 P11712 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NR2E3 Q9Y5X4 1/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36

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
SCHEMBL4868462 0.92 MAPT (0.40) MAPTHPGDLMNASIRT2PKM
SCHEMBL4872710 0.88 ALDH1A1 (0.34) PKMHSD17B10KMT2AHTTSMN1; SMN2
SCHEMBL4877231 0.88 LMNA (0.41) MAPTHPGDLMNASIRT2PKM
SCHEMBL4875218 0.87 MAPT (0.40) MAPTHPGDLMNASIRT2PKM
SCHEMBL4868481 0.87 LMNA (0.39) MAPTHPGDLMNASIRT2PKM
SCHEMBL4877469 0.82 GRIN2B (0.35) PKM
SCHEMBL4868457 0.79 NPC1 (0.38) PKMHSD17B10HTTSMN1; SMN2ALDH1A1
SCHEMBL4875677 0.78 GRIN2B (0.34) MAPTLMNAPKMKMT2ASMN1; SMN2
SCHEMBL4876599 0.78 DPP4 (0.33) MAPTRXFP1
SCHEMBL4877221 0.75 KCNA5 (0.36) LMNAKMT2ASMN1; SMN2ALDH1A1L3MBTL1

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-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 MAPT 4372/4885HPGD 2973/4885LMNA 3337/4885

“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.