SCHEMBL4312466

SCHEMBL4312466

O=S(=O)(Cl)c1cc(Br)ccc1CO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.39
GLA P06280 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
WDR5 P61964 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
TSHR P16473 1/20 0.34
EDNRB P24530 4/20 0.34
EDNRA P25101 4/20 0.34
CHEK1 O14757 1/20 0.34
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
S100A4 P26447 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CA2 P00918 2/20 0.32

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
SCHEMBL2881003 0.83 EDNRB (0.47) GLASMN1; SMN2TSHREDNRBEDNRA
SCHEMBL25609114 0.83 GLA (0.38) GLASMN1; SMN2WDR5TSHREDNRB
SCHEMBL1792921 0.81 WDR5 (0.40) PTGDR2GLASMN1; SMN2WDR5PSEN1
SCHEMBL8536911 0.79 EDNRB (0.50) GLASMN1; SMN2TSHREDNRBEDNRA
SCHEMBL29070043 0.77 L3MBTL1 (0.36) PTGDR2GLASMN1; SMN2PSEN1PSEN2
SCHEMBL1121492 0.75 WDR5 (0.53) WDR5CA12CA9BCL2MCL1
SCHEMBL197054 0.74 S100A4 (0.48) GLASMN1; SMN2WDR5TSHRS100A4
SCHEMBL29882666 0.74 LMNA (0.44) GLASMN1; SMN2WDR5TSHREDNRB
SCHEMBL198775 0.74 LMNA (0.44) GLASMN1; SMN2WDR5TSHREDNRB
SCHEMBL26676650 0.74 ALDH1A1 (0.40) PTGDR2GLASMN1; SMN2TSHREDNRB

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-7524839-B2 Compounds, their use and preparation BIOVITRUM AM (PUBL.) 2009-04-28 US disclosed
US-7087750-B2 Compounds, their use and preparation BIOVITRUM AB (SE) 2006-08-08 US disclosed
US-20050256106-A1 Novel compounds, their use and preparation BIOVITRUM AB, A STOCKHOLM, SWEDEN CORPORATION 2005-11-17 US disclosed
EP-1326830-A1 2-, 3-, 4-, OR 5-SUBSTITUTED-N1-(BENZENSULFONYL)INDOLES AND THEIR USE IN THERAPY BIOVITRUM AB (SE) 2003-07-16 EP disclosed
US-20020165251-A1 Novel compounds, their use and preparation PROXIMAGEN NEUROSCIENCE PLC (GB) 2002-11-07 US disclosed
WO-2002032863-A1 2-, 3-, 4-, OR 5-SUBSTITUTED-N1-(BENZENSULFONYL)INDOLES AND THEIR USE IN THERAPY BIOVITRUM AB (SE) 2002-04-25 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 (2 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-20020165251-A1 Novel compounds, their use and preparation HTR6, HTR1A, HTR5A PTGDR2 371/4885GLA 4544/4885SMN1; SMN2 2656/4885
US-20050256106-A1 Novel compounds, their use and preparation HTR6, HTR3C, HTR1A PTGDR2 362/4885GLA 4683/4885SMN1; SMN2 2771/4885

“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.