SCHEMBL3917757

SCHEMBL3917757

CCC(C(=O)O)N1C(=O)C(Cc2ccccc2)NC12CCN(C(=S)N(C)C1CCCCC1)CC2

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 7/20 0.35
USP19 O94966 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 3/20 0.34
AGTR2 P50052 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD11B1 P28845 1/20 0.33

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
SCHEMBL4041819 0.84 CCR5 (0.37) CCR5USP19MEN1KMT2AALDH1A1
SCHEMBL1800500 0.83 MEN1 (0.41) CCR5MEN1KMT2AALDH1A1LMNA
SCHEMBL3917759 0.83 NPSR1 (0.39) CCR5USP19MEN1KMT2AALDH1A1
SCHEMBL1801173 0.81 ALDH1A1 (0.40) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1798595 0.80 LMNA (0.46) USP19MEN1KMT2AALDH1A1LMNA
SCHEMBL1800968 0.80 CYP3A4 (0.41) MEN1KMT2AALDH1A1
SCHEMBL1798796 0.78 KMT2A (0.37) USP19MEN1KMT2AALDH1A1LMNA
SCHEMBL3928453 0.77 KDM4E (0.36) MEN1KMT2AALDH1A1LMNA
SCHEMBL1800768 0.77 KMT2A (0.43) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL1801813 0.77 CYP2C9 (0.49) MEN1KMT2AALDH1A1LMNASMN1; SMN2

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 4 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
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 CCR5 2852/4885USP19 1715/4885MEN1 1493/4885

“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.