SCHEMBL2249062

SCHEMBL2249062

CCCCCCOC(=O)CC(O)CCC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.58
GPR84 Q9NQS5 4/20 0.50
NPSR1 Q6W5P4 2/20 0.50
RAD52 P43351 1/20 0.50
FAAH O00519 1/20 0.49
DGKA P23743 1/20 0.48
HTR2C P28335 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
EPHX1 P07099 1/20 0.46
TSHR P16473 2/20 0.44
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL15234469 0.98 NAAA (0.55) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL28335027 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL10615937 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL11014334 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL27776825 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL28094928 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL14714458 0.93 GPR84 (0.59) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL8862337 0.93 NAAA (0.47) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL15234477 0.91 GPR84 (0.56) NAAAGPR84NPSR1RAD52FAAH
SCHEMBL6154932 0.91 NAAA (0.64) NAAANPSR1RAD52FAAHDGKA

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-8716182-B2 Liquid aqueous crop protection formulations BASF SE (DE) 2014-05-06 US disclosed
US-20110195839-A1 Liquid Aqueous Crop Protection Formulations BASF SE (DE) 2011-08-11 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-20110195839-A1 Liquid Aqueous Crop Protection Formulations AQP1, GANC, BROX NAAA 1486/4885GPR84 4544/4885NPSR1 3803/4885

“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.