SCHEMBL4156742

SCHEMBL4156742

CCC(=O)[N]c1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.50
HTR3B O95264 2/20 0.50
HTR3A P46098 2/20 0.50
HTR3D Q70Z44 2/20 0.50
HTR3C Q8WXA8 2/20 0.50
CYP1A2 P05177 2/20 0.46
CYP2A6 P11509 1/20 0.46
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HSP90AA1 P07900 3/20 0.44
KDM4E B2RXH2 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HPGD P15428 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
POLB P06746 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
SCHEMBL5511485 0.78 RAB9A (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2005475 0.78 GAA (0.48) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL2592 0.77 CES2 (0.43) SMN1; SMN2ALDH1A1L3MBTL1CES2CES1
SCHEMBL689997 0.76 HTR3E (0.66) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7277924 0.75 HTR3E (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL5513115 0.73 CYP2A6 (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL21192621 0.72 HTR3E (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL21192622 0.72 HTR3E (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL10740210 0.71 HTR3E (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8861492 0.71 ESR1 (0.41) CYP1A2RAB9ANPC1SMN1; SMN2ALDH1A1

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 HTR3E 230/4885HTR3B 192/4885HTR3A 97/4885

“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.