SCHEMBL322220

SCHEMBL322220

Brc1cc(-c2ccccc2)ccc1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
F2 P00734 1/20 0.52
MRGPRX4 Q96LA9 1/20 0.48
PTPN1 P18031 3/20 0.47
CCR5 P51681 1/20 0.46
SMPD1 P17405 1/20 0.46
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
TLR9 Q9NR96 1/20 0.45
PTP4A3 O75365 1/20 0.45
PRMT5 O14744 1/20 0.45
MAOB P27338 1/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL24244911 0.92 GSTP1 (0.54) RAB9ASMN1; SMN2PTPN1MAOBMAPT
SCHEMBL17488404 0.91 RAB9A (0.51) RAB9ASMN1; SMN2F2MRGPRX4PTPN1
SCHEMBL19398436 0.88 F2 (0.49) RAB9ASMN1; SMN2F2MRGPRX4KDM4E
SCHEMBL1756349 0.87 ABCC4 (0.58) RAB9ASMN1; SMN2MRGPRX4PTPN1SMPD1
SCHEMBL17293801 0.84 PTPN1 (0.55) RAB9ASMN1; SMN2F2MRGPRX4PTPN1
SCHEMBL5276838 0.84 RAB9A (0.51) RAB9ASMN1; SMN2F2PTPN1KDM4E
SCHEMBL8440333 0.84 SMN1; SMN2 (0.51) RAB9ASMN1; SMN2F2PTPN1CCR5
SCHEMBL1756387 0.83 MRGPRX4 (0.73) RAB9ASMN1; SMN2MRGPRX4HPGDMAPT
SCHEMBL7898169 0.82 RAB9A (0.59) RAB9ASMN1; SMN2PTPN1CCR5MAOB
SCHEMBL30835101 0.82 RAB9A (0.59) RAB9ASMN1; SMN2PTPN1CCR5MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590951-B1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS PFIZER LTD (GB) 2015-01-07 EP disclosed
US-8772293-B2 Chemical compounds PFIZER LIMITED (GB) 2014-07-08 US disclosed
EP-2590951-A1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS Pfizer Limited (GB) 2013-05-15 EP disclosed
WO-2012004743-A1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-01-12 WO disclosed
US-20120010182-A1 Chemical Compounds ICAGEN INC. (US) 2012-01-12 US disclosed
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED 2009-06-04 US disclosed
US-7482414-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-27 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 US 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 (3 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-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 RAB9A 977/4885SMN1; SMN2 2171/4885F2 38/4885
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 RAB9A 977/4885SMN1; SMN2 2171/4885F2 38/4885
US-20120010182-A1 Chemical Compounds SCN1A, SCN1B, CACNA1E RAB9A 247/4885SMN1; SMN2 333/4885F2 3542/4885

“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.