SCHEMBL15093708

SCHEMBL15093708

CCCCCC(NC(=O)NC(CCCCC)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 3/20 0.53
NAAA Q02083 2/20 0.51
CNR2 P34972 2/20 0.51
POLB P06746 1/20 0.51
EPHX2 P34913 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ASAH1 Q13510 2/20 0.48
ALDH1A1 P00352 1/20 0.48
ACER2 Q5QJU3 1/20 0.48
GPR88 Q9GZN0 2/20 0.46
MMP2 P08253 2/20 0.45
MMP9 P14780 2/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45
MMP14 P50281 1/20 0.45

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
SCHEMBL15093938 0.98 TACR3 (0.55) TACR3NAAACNR2POLBEPHX2
SCHEMBL15093649 0.98 TACR3 (0.55) TACR3NAAACNR2POLBEPHX2
SCHEMBL15093655 0.98 TACR3 (0.55) TACR3NAAACNR2POLBEPHX2
SCHEMBL15093823 0.98 TACR3 (0.55) TACR3NAAACNR2POLBEPHX2
SCHEMBL15093398 0.95 POLB (0.56) TACR3NAAACNR2POLBEPHX2
SCHEMBL2021993 0.90 TACR3 (0.53) TACR3NAAACNR2POLBNPSR1
SCHEMBL2024979 0.89 TACR3 (0.55) TACR3NAAACNR2POLBNPSR1
SCHEMBL2021335 0.89 TACR3 (0.55) TACR3NAAACNR2POLBNPSR1
SCHEMBL15861956 0.89 TACR3 (0.55) TACR3NAAACNR2POLBNPSR1
SCHEMBL14063604 0.89 TACR3 (0.55) TACR3NAAACNR2POLBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2679575-B1 PROCESS FOR PRODUCING CARBONYL COMPOUNDS ASAHI CHEMICAL IND (JP) 2019-04-10 EP disclosed
CN-103097348-B The manufacture method of carbonyl compound ASAHI KASEI CHEMICALS CORP. (JP) 2015-10-14 CN disclosed
US-8957241-B2 Method for producing carbonyl compound ASAHI KASEI CHEMICALS CORPORATION (JP) 2015-02-17 US disclosed
US-20130178645-A1 Method for Producing Carbonyl Compund ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-07-11 US disclosed
CN-103097348-A Process for producing carbonyl compounds ASAHI KASEI CHEMICALS CORP (JP) 2013-05-08 CN 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-20130178645-A1 Method for Producing Carbonyl Compund CA6, CPS1, C9 TACR3 3595/4885NAAA 1059/4885CNR2 1956/4885

“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.