SCHEMBL4859201

SCHEMBL4859201

CCOC(=O)Cn1c(CC)nc(-c2ccccc2)cc1=O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.56
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
FAAH O00519 2/20 0.48
TSHR P16473 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ENPP2 Q13822 1/20 0.47

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
SCHEMBL4850739 0.86 GSK3B (0.47) KDM4EMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL11277508 0.79 KDM4E (0.58) HTTCYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL4858963 0.77 ALDH1A1 (0.45) KDM4EALDH1A1FAAHL3MBTL1
SCHEMBL4856384 0.76 KAT2B (0.45) HTTCYP1A2KDM4EMEN1KMT2A
SCHEMBL4859153 0.76 GSK3B (0.51) KDM4EMEN1KMT2AALDH1A1
SCHEMBL4850527 0.76 GSK3B (0.51) KDM4EMEN1KMT2AALDH1A1
SCHEMBL14263926 0.75 LMNA (0.43) HTTKDM4EMEN1KMT2AALDH1A1
SCHEMBL17401408 0.74 ENPP2 (0.80) ENPP2
SCHEMBL5659043 0.74 PPARA (0.52)
SCHEMBL4861486 0.74 PPARA (0.44) CYP1A2FAAHTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7348334-B2 Monocyclic derivatives of aryl alkanoic acids and their use in medicine: process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2008-03-25 US disclosed
US-20030013729-A1 New monocyclic derivatives of aryl alkanoic acids and their use in medicine: process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LTD. 2003-01-16 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-20030013729-A1 New monocyclic derivatives of aryl alkanoic acids and their use in medicine: process for their preparation and pharmaceutical compositions containing them GPR119, FFAR1, FFAR3 HTT 1033/4885CYP1A2 101/4885CYP2C9 30/4885

“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.