SCHEMBL9912809

SCHEMBL9912809

CCCCOC(=O)CCC(=O)CNCl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.54
DGKA P23743 1/20 0.47
FAAH O00519 2/20 0.44
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 3/20 0.42
DNM1 Q05193 1/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 1/20 0.39
MGLL Q99685 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
CNR1 P21554 1/20 0.38
EPHX2 P34913 2/20 0.38
MAPK1 P28482 1/20 0.38
RAD52 P43351 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
SCHEMBL9912765 0.95 HTR2C (0.61) HTR2CDGKAFAAHNAAAALDH1A1
SCHEMBL9947101 0.83 ALDH1A1 (0.50) HTR2CDGKAFAAHNAAAALDH1A1
SCHEMBL13855617 0.81 TSHR (0.44) HTR2CDGKAALDH1A1LMNATSHR
Dibutylsuccinate SCHEMBL50411 0.81 DGKA (0.67) HTR2CDGKAFAAHNAAAALDH1A1
Dibutylsuccinate SCHEMBL3977806 0.81 DGKA (0.67) HTR2CDGKAFAAHNAAAALDH1A1
SCHEMBL9912810 0.81 FAAH (0.40) HTR2CDGKAFAAHALDH1A1MGLL
SCHEMBL13855616 0.81 ADRA2A (0.38) HTR2CDGKALMNATSHRMAPT
SCHEMBL4807593 0.80 HTR2C (0.59) HTR2CDGKAFAAHNAAAALDH1A1
SCHEMBL3954254 0.80 HTR2C (0.62) HTR2CDGKAFAAHNAAAALDH1A1
SCHEMBL28189024 0.80 HTR2C (0.62) HTR2CDGKAFAAHNAAAALDH1A1

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-8198325-B2 Unsaturated alkyl esters of 5-aminolevulinic acid, their preparation and their use INDUSTRY FOUNDATION OF CHONNAM NATIONAL UNIVERSITY (KR) 2012-06-12 US disclosed
US-20090176881-A1 Unsaturated Alkyl Esters of 5-Aminolevulinic Acid, their Preparation and their Use INDUSTRY FOUNDATION OF CHONNAM NATIONAL UNIVERSITY (KR) 2009-07-09 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-20090176881-A1 Unsaturated Alkyl Esters of 5-Aminolevulinic Acid, their Preparation and their Use ALAD, ALOX5, SLC7A1 HTR2C 1116/4885DGKA 2663/4885FAAH 873/4885

“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.