SCHEMBL8304218

SCHEMBL8304218

COC(=O)[C@H]1C[C@H](C(=O)OC)N1Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.57
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
KMT2A Q03164 2/20 0.57
FKBP1A P62942 1/20 0.53
TRPM8 Q7Z2W7 1/20 0.51
MAPT P10636 1/20 0.51
SLC6A4 P31645 1/20 0.49
SLC6A3 Q01959 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL9356129 1.00 CYP3A4 (0.57) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL8304214 1.00 CYP3A4 (0.57) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL8304211 1.00 CYP3A4 (0.57) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL5458626 0.95 CYP3A4 (0.54) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL5451605 0.95 CYP3A4 (0.54) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL9352245 0.95 CYP3A4 (0.54) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL9352229 0.92 KMT2A (0.55) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL15406170 0.90 FKBP1A (0.56) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL5965409 0.90 FKBP1A (0.56) CYP3A4KDM4EALDH1A1KMT2AFKBP1A
SCHEMBL6684412 0.89 CYP3A4 (0.54) CYP3A4KDM4EALDH1A1KMT2AFKBP1A

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-0607374-B1 NOVEL CYCLIC LIPID DERIVATIVES AS POTENT PAF ANTAGONISTS PO HANG IRON & STEEL (KR) 1999-04-07 EP disclosed
US-5700817-A Cyclic lipid derivatives as potent PAF antagonists POHANG IRON & STEEL CO., LTD. (KR) 1997-12-23 US disclosed
US-5610310-A Cyclic lipid derivatives as potent PAF antagonists POHANG IRON & STEEL CO., LTD (KR) 1997-03-11 US disclosed
EP-0607374-A1 NOVEL CYCLIC LIPID DERIVATIVES AS POTENT PAF ANTAGONISTS POHANG IRON & STEEL CO., LTD. (KR) 1994-07-27 EP disclosed
WO-1994000447-A1 NOVEL CYCLIC LIPID DERIVATIVES AS POTENT PAF ANTAGONISTS POHANG IRON & STEEL CO., LTD. (KR) 1994-01-06 WO disclosed