SCHEMBL6548237

SCHEMBL6548237

O=S(=O)(c1ccccc1)c1ccc(Br)c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.49
FABP4 P15090 2/20 0.46
FABP5 Q01469 1/20 0.44
RXFP1 Q9HBX9 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK10 P53779 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MEN1 O00255 1/20 0.44
MET P08581 1/20 0.41
SLC40A1 Q9NP59 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
LDHA P00338 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
SCHEMBL30999723 0.88 HTR6 (0.62) HTR6KMT2ANPSR1METPOLB
SCHEMBL15514563 0.78 LDHA (0.64) FABP4FABP5RXFP1KMT2AMAPK10
SCHEMBL10693393 0.77 LDHA (0.63) HTR6POLBGAAGFERLDHA
SCHEMBL6548757 0.77 ALDH1A1 (0.54) HTR6FABP4KMT2ANPSR1MET
SCHEMBL3578778 0.76 FABP4 (0.51) FABP4FABP5RXFP1KMT2AMAPK10
SCHEMBL2385214 0.76 RXFP1 (0.46) HTR6FABP4FABP5RXFP1KMT2A
SCHEMBL15461558 0.76 RXFP1 (0.50) FABP4FABP5RXFP1KMT2AMAPK10
SCHEMBL30987398 0.76 RXFP1 (0.46) HTR6FABP4FABP5RXFP1KMT2A
SCHEMBL3833910 0.75 CA1 (0.58) HTR6KMT2ANPSR1POLBGAA
SCHEMBL6614757 0.74 FABP4 (0.50) FABP4FABP5RXFP1KMT2AMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478361-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
US-20030220325-A1 Such as 1-(4-(phenylsulfonyl)-naphthyl)piperazine; for treating treating diseases related to 5-HT receptor; radiolabelling PHARMACIA & UPJOHN COMPANY 2003-11-27 US disclosed
WO-2003072558-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 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-20030220325-A1 Such as 1-(4-(phenylsulfonyl)-naphthyl)piperazine; for treating treating diseases related to 5-HT receptor; radiolabelling HTR6, TPH1, HTR5A HTR6 1/4885FABP4 1927/4885FABP5 662/4885

“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.