SCHEMBL4919602

SCHEMBL4919602

BrC1CCCN1c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
PLD1 Q13393 1/20 0.42
KDM4E B2RXH2 5/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6354342 0.79 KDM4E (0.43) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL15201158 0.79 HRH3 (0.50) ALDH1A1MAPTHTTKDM4EL3MBTL1
SCHEMBL1928736 0.79 ALDH1A1 (0.43) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL14360624 0.79 HRH3 (0.50) ALDH1A1MAPTHTTKDM4EL3MBTL1
SCHEMBL20336407 0.78 ALDH1A1 (0.42) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL23064491 0.77 ALDH1A1 (0.57) ALDH1A1MAPTHTTKDM4EL3MBTL1
SCHEMBL28811056 0.76 CHI3L1 (0.46) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL21937769 0.76 AR (0.46) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL28811057 0.76 CHI3L1 (0.46) ALDH1A1MAPTHTTPLD1KDM4E
SCHEMBL8326245 0.76 SYK (0.48) PLD1

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-20120214808-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LIMITED (GB) 2012-08-23 US disclosed
US-20080261952-A1 Aryl Urea Derivatives for Treating Obesity PROSIDION LTD. (GB) 2008-10-23 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 (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-20080261952-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R ALDH1A1 274/4885MAPT 4151/4885HTT 1967/4885
US-20120214808-A1 Aryl Urea Derivatives for Treating Obesity CNR1, GPR119, UTS2R ALDH1A1 274/4885MAPT 4151/4885HTT 1967/4885

“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.