SCHEMBL5855995

SCHEMBL5855995

CC(=O)CNC(=O)C1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
HSD17B10 Q99714 1/20 0.55
NAAA Q02083 1/20 0.53
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
PSMB5 P28074 2/20 0.49
DPP4 P27487 2/20 0.47
PREP P48147 2/20 0.47
FAP Q12884 2/20 0.47
ALDH1A1 P00352 1/20 0.47
USP2 O75604 1/20 0.45
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CTSK P43235 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
SCHEMBL19302833 1.00 EPHX1 (0.57) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL12019238 0.89 KMT2A (0.48) EPHX1SMN1; SMN2HSD17B10NAAAPSMB5
SCHEMBL12508317 0.82 PSMB5 (0.44) EPHX1SMN1; SMN2HSD17B10NAAAPSMB5
SCHEMBL1449384 0.81 EPHX1 (0.59) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL15865900 0.81 EPHX1 (0.59) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL6136977 0.80 EPHX1 (0.63) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL13574437 0.80 KMT2A (0.41) EPHX1SMN1; SMN2HSD17B10NAAAPSMB5
SCHEMBL28367593 0.80 EPHX2 (0.59) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL21558248 0.80 PSMB5 (0.54) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8
SCHEMBL28095544 0.80 EPHX2 (0.59) EPHX1SMN1; SMN2HSD17B10NAAAHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP 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 (4 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB EPHX1 465/4885SMN1; SMN2 4207/4885HSD17B10 35/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE EPHX1 247/4885SMN1; SMN2 4287/4885HSD17B10 37/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC EPHX1 124/4885SMN1; SMN2 4370/4885HSD17B10 39/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC EPHX1 124/4885SMN1; SMN2 4370/4885HSD17B10 39/4885

“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.