SCHEMBL4337764

SCHEMBL4337764

Oc1ccc(Cl)cc1Sc1cccc(F)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.59
ALDH1A1 P00352 2/20 0.59
HPGD P15428 2/20 0.59
ALOX15 P16050 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
PLA2G1B P04054 1/20 0.59
HSP90AA1 P07900 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTT P42858 1/20 0.59
HIF1A Q16665 1/20 0.59
ATG4B Q9Y4P1 1/20 0.59
SLC6A9 P48067 4/20 0.43
HAO1 Q9UJM8 1/20 0.42
IDO1 P14902 2/20 0.40
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL4336068 0.87 SLC6A9 (0.43) HSD17B10ALDH1A1HPGDALOX15MEN1
SCHEMBL28016921 0.81 HSD17B10 (0.70) HSD17B10ALDH1A1HPGDALOX15MEN1
SCHEMBL4338534 0.81 HAO1 (0.39) HSD17B10ALDH1A1HPGDALOX15MEN1
SCHEMBL11759128 0.80 SLC6A9 (0.43) HSD17B10ALDH1A1HPGDALOX15MEN1
SCHEMBL4337657 0.80 SLC6A9 (0.43) ALDH1A1HPGDMEN1KMT2AHTT
SCHEMBL11760302 0.79 GRIK1 (0.49) ALDH1A1HPGDMEN1KMT2ASLC6A9
SCHEMBL11761120 0.78 ATM (0.43) PLA2G1BATG4BSLC6A9HAO1IDO1
SCHEMBL4338317 0.78 ESR2 (0.49) HSD17B10ALDH1A1HPGDALOX15MEN1
SCHEMBL11757879 0.78 SLC6A4 (0.51) SLC6A9HAO1IDO1MAPK1RHEB
SCHEMBL4330280 0.77 MAOA (0.38) SLC6A9HAO1NQO2PTGS1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612068-B2 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2009-11-03 US disclosed
CN-100439330-C Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives LUNDBECK & CO AS H (DK) 2008-12-03 CN disclosed
US-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2006-10-19 US disclosed
CN-1780815-A Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives LUNDBECK & CO AS H (DK) 2006-05-31 CN disclosed
EP-1622868-A1 AROMATIC OXYPHENYL AND AROMATIC SULFANYLPHENYL DERIVATIVES H. LUNDBECK A/S (DK) 2006-02-08 EP disclosed
WO-2004096761-A1 AROMATIC OXYPHENYL AND AROMATIC SULFANYLPHENYL DERIVATIVES H. LUNDBECK A/S (DK) 2004-11-11 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-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives TYR, TPST2, COMT HSD17B10 1264/4885ALDH1A1 425/4885HPGD 2221/4885

“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.