SCHEMBL3198633

SCHEMBL3198633

O=C(O)C1=C(c2ccc(-c3ccccc3)cc2)COCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ DHODH Q02127 3/20 0.42
▸ KMT2A Q03164 4/20 0.38
▸ MAPT P10636 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ PTPN1 P18031 1/20 0.36
▸ HNF4A P41235 2/20 0.35

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
SCHEMBL3200733 0.87 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3DHODHKMT2A
SCHEMBL3186865 0.80 CHRM2 (0.50) SLC6A2SLC6A4SLC6A3MAPTSMN1; SMN2
SCHEMBL3195494 0.74 SLC6A3 (0.63) SLC6A2SLC6A4SLC6A3
SCHEMBL10384372 0.74 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3DHODHKMT2A
SCHEMBL3205013 0.71 CHRM5 (0.53) SLC6A2SLC6A4SLC6A3KDM4EALDH1A1
SCHEMBL4350872 0.71 SLC6A3 (0.65) SLC6A2SLC6A4SLC6A3DHODH
SCHEMBL1751614 0.71 SLC6A3 (0.65) SLC6A2SLC6A4SLC6A3DHODH
SCHEMBL1752157 0.71 SLC6A3 (0.65) SLC6A2SLC6A4SLC6A3DHODH
SCHEMBL1751726 0.71 SLC6A3 (0.60) SLC6A2SLC6A4SLC6A3DHODH
SCHEMBL1751676 0.71 SLC6A3 (0.65) SLC6A2SLC6A4SLC6A3DHODH

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
US-20100035865-A1 Sulfonamides and Pharmaceutical Compositions Thereof PFIZER INC 2010-02-11 — — US disclosed
EP-2142505-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer, Inc. (US) 2010-01-13 — — EP disclosed
WO-2008120093-A1 SULFONAMIDES AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER INC. (US) 2008-10-09 — — 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-20100035865-A1 Sulfonamides and Pharmaceutical Compositions Thereof STS, SULT2A1, SULT1A1 SLC6A2 1663/4885SLC6A4 647/4885SLC6A3 1176/4885

“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.

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