SCHEMBL5098012

SCHEMBL5098012

Cc1cc(C(=O)NC2(C(=O)O)CCCCC2)no1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
LMNA P02545 3/20 0.45
GAA P10253 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 6/20 0.44
TP53 P04637 2/20 0.44
GLA P06280 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
USP2 O75604 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
PTGS2 P35354 1/20 0.43
GFER P55789 1/20 0.43
S1PR3 Q99500 1/20 0.43
PKM P14618 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL5105697 0.72 SMN1; SMN2 (0.51) MAPTNPC1RAB9ALMNAALDH1A1
SCHEMBL5097601 0.71 NPC1 (0.48) NPC1RAB9AALDH1A1TP53SMN1; SMN2
SCHEMBL1840355 0.70 GAA (0.60) MAPTNPC1RAB9ALMNAGAA
SCHEMBL464163 0.70 PABPC1 (0.52) MAPTNPC1RAB9ALMNATP53
SCHEMBL30321089 0.70 GPR132 (0.40) LMNAGAAALDH1A1
SCHEMBL345038 0.69 MAPT (0.67) MAPTNPC1RAB9ALMNAGAA
SCHEMBL22883817 0.69 NPC1 (0.71) NPC1RAB9AGAAALDH1A1SMN1; SMN2
SCHEMBL1837001 0.69 KDM4E (0.47) MAPTNPC1RAB9AGAAALDH1A1
SCHEMBL1839397 0.69 ERAP1 (0.43) LMNAGAAALDH1A1
SCHEMBL5098144 0.69 LMNA (0.52) NPC1RAB9ALMNACYP2C19ALDH1A1

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 MAPT 1544/4885NPC1 729/4885RAB9A 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.