SCHEMBL4338317

SCHEMBL4338317

Oc1ccc(-c2ccccc2)cc1Sc1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.49
SLC6A9 P48067 8/20 0.47
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HSP90AA1 P07900 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALOX5 P09917 1/20 0.44
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
TAAR1 Q96RJ0 2/20 0.41

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
SCHEMBL6271472 0.85 ALOX5 (0.55) ESR2KDM4EMEN1USP2ALDH1A1
SCHEMBL27642331 0.85 SLC6A9 (0.43) ESR2SLC6A9KDM4EMEN1USP2
SCHEMBL4337657 0.80 SLC6A9 (0.43) ESR2SLC6A9KDM4EMEN1ALDH1A1
SCHEMBL7561256 0.80 ALOX5 (0.61) ESR2KDM4EMEN1USP2ALDH1A1
SCHEMBL4343066 0.78 SLC6A9 (0.52) SLC6A9
SCHEMBL4338534 0.78 HAO1 (0.39) SLC6A9MEN1ALDH1A1LMNAHSP90AA1
SCHEMBL4337764 0.78 HSD17B10 (0.59) SLC6A9MEN1ALDH1A1HSP90AA1HPGD
SCHEMBL4334288 0.78 SLC6A9 (0.62) ESR2SLC6A9
SCHEMBL4330280 0.75 MAOA (0.38) SLC6A9
SCHEMBL15190516 0.73 ALOX5 (0.61) ESR2KDM4EMEN1USP2ALDH1A1

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 ESR2 840/4885SLC6A9 2305/4885KDM4E 1025/4885

“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.