SCHEMBL3925966

SCHEMBL3925966

CCCCN1C(=O)C(C(C)C)NC12CCN(C(=O)Nc1cccc(C(=O)OCC)c1)CC2

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 2/20 0.42
CCR2 P41597 1/20 0.42
ALDH1A1 P00352 3/20 0.42
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.42
NPY2R P49146 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL4036406 0.76 UBE2M (0.39) KMT2AALDH1A1LMNATSHR
SCHEMBL5912854 0.75 MAPT (0.56) MAPTNPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL5912062 0.74 MAPT (0.55) MAPTNPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL3918182 0.74 SMN1; SMN2 (0.47) MAPTNPC1RAB9ASMN1; SMN2KMT2A
Benzamide SCHEMBL3918735 0.73 CYP3A4 (0.40) CYP2C9KMT2AALDH1A1LMNA
SCHEMBL5912442 0.72 MAPT (0.59) MAPTNPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL5912202 0.71 MAPT (0.64) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3916730 0.71 CYP3A4 (0.39) CYP2C9
SCHEMBL5911754 0.69 MAPT (0.66) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4032617 0.69 ALDH1A1 (0.41) MAPTSMN1; SMN2CYP1A2CYP2C9CYP2C19

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
US-7560468-B2 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2009-07-14 US claimed
EP-1730144-B1 SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS GRUENENTHAL GMBH (DE) 2009-06-10 EP claimed
US-20070015783-A1 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US claimed
US-7560468-B2 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2009-07-14 US disclosed
US-20070015783-A1 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 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-20070015783-A1 Substituted 1,4,8-triazaspiro[4,5]decan-2-one compounds THPO, UGT1A8, UGT1A4 MAPT 689/4885NPC1 69/4885RAB9A 873/4885

“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.