SCHEMBL2054762

SCHEMBL2054762

O=C(NC(c1ccc(F)cc1)c1ccc(S(=O)(=O)CC2CC2)cc1)c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 6/20 0.53
FLT4 P35916 6/20 0.53
KDR P35968 6/20 0.53
SLC6A9 P48067 8/20 0.44
P2RX7 Q99572 1/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.40
EPHX2 P34913 1/20 0.40
AVPR2 P30518 1/20 0.40
GPR27 Q9NS67 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
SCHEMBL2054761 0.91 FLT1 (0.47) FLT1FLT4KDRSLC6A9P2RX7
SCHEMBL2054757 0.85 SLC6A9 (0.47) FLT1FLT4KDRSLC6A9P2RX7
Iodide SCHEMBL2098401 0.83 SLC6A9 (0.40) FLT1FLT4KDRSLC6A9NPC1
SCHEMBL2054758 0.81 SLC6A9 (0.42) FLT1FLT4KDRSLC6A9
SCHEMBL2095689 0.80 POLB (0.44) FLT1FLT4KDRSLC6A9NPC1
SCHEMBL2054764 0.80 SLC6A9 (0.45) FLT1FLT4KDRSLC6A9P2RX7
SCHEMBL2054767 0.79 MEN1 (0.46) FLT1FLT4KDRSLC6A9P2RX7
SCHEMBL2054781 0.79 AKT1 (0.46) FLT1FLT4KDRSLC6A9NPC1
SCHEMBL2054783 0.79 SLC6A9 (0.49) FLT1FLT4KDRSLC6A9
SCHEMBL13618870 0.77 SLC6A9 (0.46) FLT1FLT4KDRSLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899294-B1 THERAPEUTIC AGENTS MERCK SHARP & DOHME (GB) 2015-03-18 EP disclosed
US-8163956-B2 Inhibitors of GLYT1 transporters MERCK SHARP & DOHME CORP. (US) 2012-04-24 US disclosed
US-8163956-B2 Inhibitors of GLYT1 transporters MERCK SHARP & DOHME CORP. (US) 2012-04-24 US disclosed
US-8163956-B2 Inhibitors of GLYT1 transporters MERCK SHARP & DOHME CORP. (US) 2012-04-24 US disclosed
US-20090286765-A1 Therapeutic Agents MERCK SHARP & DOHME (UK) LIMITED (GB) 2009-11-19 US disclosed
US-20090286765-A1 Therapeutic Agents MERCK SHARP & DOHME (UK) LIMITED (GB) 2009-11-19 US disclosed
US-20090286765-A1 Therapeutic Agents MERCK SHARP & DOHME (UK) LIMITED (GB) 2009-11-19 US disclosed
WO-2006134341-A1 THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2006-12-21 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-20090286765-A1 Therapeutic Agents GRIA1, GRIN1, GLRA1 FLT1 3337/4885FLT4 4225/4885KDR 4339/4885

“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.