SCHEMBL5954493

SCHEMBL5954493

CN(C)CCC(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
TSHR P16473 1/20 0.55
UTS2R Q9UKP6 3/20 0.45
RAB9A P51151 4/20 0.45
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 2/20 0.45
HTT P42858 1/20 0.45
VNN1 O95497 1/20 0.45
GAA P10253 1/20 0.44
CNR2 P34972 2/20 0.44
CTBP2 P56545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
AOC3 Q16853 1/20 0.42

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
SCHEMBL6946103 0.82 TAAR1 (0.53) ALDH1A1HTTVNN1GAACTBP2
SCHEMBL5954642 0.81 L3MBTL1 (0.50) L3MBTL1TSHRRAB9AALDH1A1NPC1
SCHEMBL7256785 0.79 ALDH1A1 (0.49) L3MBTL1RAB9AALDH1A1NPC1VNN1
SCHEMBL1479915 0.78 NPC1 (0.55) L3MBTL1RAB9AALDH1A1NPC1HTT
SCHEMBL11221142 0.77 L3MBTL1 (0.58) L3MBTL1RAB9ANPC1VNN1CTBP2
SCHEMBL1538218 0.76 ALDH1A1 (0.58) L3MBTL1RAB9AALDH1A1NPC1VNN1
SCHEMBL11388782 0.76 CTBP2 (0.50) L3MBTL1RAB9AALDH1A1NPC1VNN1
SCHEMBL12731514 0.76 NPC1 (0.46) L3MBTL1RAB9AALDH1A1NPC1HTT
SCHEMBL11622858 0.75 PPARG (0.47) L3MBTL1RAB9AALDH1A1NPC1VNN1
SCHEMBL3070923 0.75 L3MBTL1 (0.52) L3MBTL1RAB9AALDH1A1NPC1GAA

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-20060058374-A1 Urotensin II receptor agents ACADIA PHARMACEUTICALS INC. 2006-03-16 US disclosed
US-20040077529-A1 Urotensin II receptor agents ACADIA PHARMACEUTICALS, INC. 2004-04-22 US disclosed
WO-2003104216-A1 UROTENSIN II RECEPTOR MODULATORS ACADIA PHARMACEUTICALS INC. (US) 2003-12-18 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 (2 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-20040077529-A1 Urotensin II receptor agents UTS2R, PLAUR, GPR17 L3MBTL1 4695/4885TSHR 367/4885UTS2R 1/4885
US-20060058374-A1 Urotensin II receptor agents UTS2R, PLAUR, SCTR L3MBTL1 4725/4885TSHR 316/4885UTS2R 1/4885

“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.