SCHEMBL5110774

SCHEMBL5110774

O=C(NC1(C(=O)O)CCCCC1)C(=O)c1ccc(Cl)nc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 1/20 0.46
▸ FPR2 P25090 1/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ GPR132 Q9UNW8 1/20 0.38
▸ LPAR1 Q92633 2/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ FABP4 P15090 3/20 0.36
▸ FABP5 Q01469 3/20 0.36
▸ KCNQ3 O43525 2/20 0.36
▸ KCNQ2 O43526 2/20 0.36
▸ KCNE1 P15382 1/20 0.36
▸ KCNQ1 P51787 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
SCHEMBL5110772 0.78 FPR2 (0.44) FPR2RAB9ANPC1GPR132MEN1
SCHEMBL5102088 0.76 LATS1 (0.41) NAPRTGPR132MEN1KMT2A
SCHEMBL1839626 0.71 GPR132 (0.47) GPR132LPAR1
SCHEMBL2088153 0.69 CNR2 (0.47) NAPRTRAB9ASMN1; SMN2MAPTL3MBTL1
SCHEMBL26081149 0.69 NAPRT (0.50) NAPRTRAB9ASMN1; SMN2MAPTL3MBTL1
SCHEMBL6242505 0.68 L3MBTL1 (0.62) RAB9ASMN1; SMN2MAPTL3MBTL1NPC1
6-Chloronicotinic Acid SCHEMBL29524158 0.66 NAPRT (1.00) NAPRTRAB9ASMN1; SMN2MAPTL3MBTL1
6-Chloronicotinic Acid SCHEMBL104580 0.66 NAPRT (1.00) NAPRTRAB9ASMN1; SMN2MAPTL3MBTL1
SCHEMBL17796645 0.65 AKR1C1 (0.53) NAPRTRAB9ASMN1; SMN2MAPTMEN1
SCHEMBL29886401 0.65 AKR1C1 (0.53) NAPRTRAB9ASMN1; SMN2MAPTMEN1

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-7342027-B2 1-phenylpiperidin-3-one derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2008-03-11 — — US disclosed
US-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof DONG-A PHARMACEUTICAL CO., LTD. (KR) 2005-10-20 — — US disclosed
WO-2004011457-A1 1-PHENYLPIPERIDIN-3-ONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2004-02-05 — — 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-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof CTRL, PRCP, CLPP NAPRT 2577/4885FPR2 2996/4885RAB9A 2273/4885

“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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