SCHEMBL4337657

SCHEMBL4337657

Oc1ccccc1Sc1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 5/20 0.43
HAO1 Q9UJM8 1/20 0.42
EPHX1 P07099 1/20 0.40
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
ESR2 Q92731 1/20 0.36
NQO2 P16083 1/20 0.36
PTGS1 P23219 1/20 0.36
MPO P05164 1/20 0.36
ALDH1A1 P00352 1/20 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
SCHEMBL28016930 0.85 CA12 (0.36) SLC6A9KDM4EMEN1NPC1LMNA
SCHEMBL7938044 0.81 SMN1; SMN2 (0.47) KDM4ENPC1LMNAMAPTHPGD
SCHEMBL7938589 0.81 PGR (0.46) SLC6A9HAO1EPHX1
SCHEMBL4338317 0.80 ESR2 (0.49) SLC6A9KDM4EMEN1LMNAMAPT
SCHEMBL4337764 0.80 HSD17B10 (0.59) SLC6A9HAO1MEN1HPGDTSHR
SCHEMBL4338534 0.80 HAO1 (0.39) SLC6A9HAO1EPHX1MEN1LMNA
SCHEMBL4336372 0.80 HAO1 (0.39) SLC6A9HAO1EPHX1MAPTHTT
SCHEMBL4336068 0.80 SLC6A9 (0.43) SLC6A9HAO1MEN1HPGDTSHR
SCHEMBL28647118 0.79 ALDH1A1 (0.45) SLC6A9KDM4EMEN1NPC1LMNA
SCHEMBL30567151 0.78 MEN1 (0.43) SLC6A9HAO1EPHX1MEN1LMNA

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 4 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
US-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2006-10-19 US 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 SLC6A9 2305/4885HAO1 1672/4885EPHX1 972/4885

“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.