SCHEMBL3185232

SCHEMBL3185232

O=C(O)C1CCOCC1c1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
FFAR1 O14842 3/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
LMNA P02545 1/20 0.41
KDM1A O60341 4/20 0.41
MAOB P27338 1/20 0.41
RORC P51449 3/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
EPHX1 P07099 1/20 0.39

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
SCHEMBL3185240 1.00 RAB9A (0.46) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL3192842 1.00 RAB9A (0.46) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL3185226 1.00 RAB9A (0.46) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL3192829 1.00 RAB9A (0.46) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL2234047 0.91 RORC (0.44) RAB9ANPC1FFAR1KDM1AMAOB
SCHEMBL2234050 0.91 RORC (0.44) RAB9ANPC1FFAR1KDM1AMAOB
SCHEMBL3184345 0.88 SLC6A2 (0.48) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL3184339 0.88 SLC6A2 (0.48) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL3184354 0.88 SLC6A2 (0.48) RAB9ANPC1FFAR1SLC6A2SLC6A4
SCHEMBL2190273 0.83 SLC6A4 (0.38) FFAR1SLC6A2SLC6A4RORC

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 RAB9A 3943/4885NPC1 2217/4885FFAR1 2697/4885

“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.