SCHEMBL31195069

SCHEMBL31195069

O=C(O)C1C(CO)CC(O)CC1c1ccc(Br)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 2/20 0.44
▸ HTR2B P41595 2/20 0.44
▸ KDM1A O60341 5/20 0.38
▸ KCNH2 Q12809 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ RCOR1 Q9UKL0 2/20 0.38
▸ KDM1B Q8NB78 1/20 0.38
▸ SLC6A3 Q01959 7/20 0.37
▸ SLC6A4 P31645 4/20 0.37
▸ SLC6A2 P23975 3/20 0.36
▸ RORC P51449 1/20 0.36

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
SCHEMBL31195001 1.00 HTR2C (0.44) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31195032 0.80 SLC6A3 (0.41) HTR2CHTR2BSLC6A3SLC6A4SLC6A2
SCHEMBL31195079 0.80 SLC6A3 (0.41) HTR2CHTR2BSLC6A3SLC6A4SLC6A2
SCHEMBL31195009 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31195030 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31195027 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31335269 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31195026 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31195005 0.78 HDAC8 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB
SCHEMBL31335235 0.78 CYP2C9 (0.39) HTR2CHTR2BKDM1AKCNH2MAOB

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-4719605-A1 CHEMICAL COMPOUNDS AND USES THEREOF GlaxoSmithKline Intellectual Property (No.4) Limited (GB) 2026-04-08 — — EP disclosed
WO-2024246863-A1 CHEMICAL COMPOUNDS AND USES THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.4) LIMITED (GB) 2024-12-05 — — WO disclosed
WO-2024246862-A1 CHEMICAL COMPOUNDS AND USES THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 4) LIMITED (GB) 2024-12-05 — — WO disclosed
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