SCHEMBL7567148

SCHEMBL7567148

CCOC(=O)CN[C@H](C)[C@H](CCc1ccsc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HPGD P15428 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
F10 P00742 2/20 0.38
F2 P00734 2/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
LTA4H P09960 1/20 0.35
SIRT5 Q9NXA8 1/20 0.35
PPID Q08752 1/20 0.35

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
SCHEMBL7561017 0.89 SMN1; SMN2 (0.45) NPC1RAB9AHPGDCRHBPCRHR2
SCHEMBL7561006 0.83 SMN1; SMN2 (0.44) NPC1RAB9AHPGDCRHBPCRHR2
SCHEMBL7561981 0.81 SMN1; SMN2 (0.47) SMN1; SMN2OPRM1
SCHEMBL7561384 0.80 ALDH1A1 (0.43) HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL7563408 0.77 NPSR1 (0.47) MAPTSMN1; SMN2ALDH1A1
SCHEMBL7561001 0.76 MMP13 (0.39) HPGDSMN1; SMN2ALDH1A1HTTPPARG
SCHEMBL7563170 0.75 NPSR1 (0.45) F10F2MAPTSMN1; SMN2
SCHEMBL7567526 0.72 HRH4 (0.44) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL7570883 0.70 LMNA (0.46) HPGDMAPTSMN1; SMN2HTT
SCHEMBL20573131 0.67 NPC1 (0.52) NPC1RAB9AHPGDCRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882703-B1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-08-14 EP disclosed
US-6011174-A INHIBIT PROTEIN-FARNESYL TRANSFERASE (PFT) IN VIVO THEREBY TO SUPPRESS FUNCTION OF ONCOGENE PROTEIN RAS AND THUS PRESENT ANTITUMOR ACTIVITIES, BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-04 US disclosed
EP-0882703-A1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed