SCHEMBL4152944

SCHEMBL4152944

Cc1ccccc1[N]C(=O)C1CCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
RECQL P46063 1/20 0.37
HTT P42858 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HPGD P15428 2/20 0.36
CYP2C9 P11712 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
KDM2B Q8NHM5 1/20 0.35

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
SCHEMBL4170402 0.97 P2RX7 (0.45) P2RX7LMNATSHRNPC1RAB9A
SCHEMBL4154113 0.74 HPGD (0.43) LMNAL3MBTL1RECQLHTTHDAC1
SCHEMBL4163322 0.71 L3MBTL1 (0.41) TSHRL3MBTL1NPC1RAB9AHTT
SCHEMBL4173665 0.71 HPGD (0.46) LMNANPC1RAB9ARECQLHDAC1
SCHEMBL4159491 0.70 GAA (0.49) NPC1RAB9AGAA
SCHEMBL4533236 0.70 SIGMAR1 (0.46) LMNATSHRL3MBTL1NPC1RAB9A
SCHEMBL23579159 0.69 NPC1 (0.56) P2RX7TSHRNPC1RAB9AHTT
SCHEMBL3184732 0.69 HPGD (0.49) LMNATSHRNPC1RAB9AHDAC1
SCHEMBL4159720 0.68 NPC1 (0.41) LMNATSHRL3MBTL1NPC1RAB9A
SCHEMBL4160499 0.68 P2RX7 (0.35) P2RX7LMNATSHRNPC1RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS LABORATORIOS SALVAT, S.A. (ES) 2009-04-02 US 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-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS PPARG, PPARD, TYRO3 P2RX7 2513/4885LMNA 4048/4885TSHR 23/4885

“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.