SCHEMBL1804472

SCHEMBL1804472

CCC(C(=O)O)N1C(=O)C(CCSC)NC12CCN(C(=O)c1ccnc(Cl)c1)CC2

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 3/20 0.35
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
POLB P06746 1/20 0.33
GFER P55789 1/20 0.33
TACR3 P29371 1/20 0.32
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
MGLL Q99685 1/20 0.31
SMYD3 Q9H7B4 1/20 0.30

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
SCHEMBL1800448 0.86 KMT2A (0.40) PROKR1KMT2AMEN1MGLL
SCHEMBL2943567 0.85 PROKR1 (0.36) PROKR1KMT2AMEN1GFERTACR3
SCHEMBL1801988 0.83 CHRNA4 (0.36)
SCHEMBL1799557 0.83 HPGD (0.39) KMT2AMEN1
SCHEMBL1800342 0.83 MAPT (0.42) KMT2AMEN1POLB
SCHEMBL1803209 0.82 TSHR (0.38) KMT2AMEN1ACACBACACA
SCHEMBL1801867 0.82 ATM (0.41) KMT2AMEN1POLBMGLL
SCHEMBL1802416 0.80 HRH3 (0.48) MGLL
SCHEMBL1798634 0.80 GAA (0.38) POLB
SCHEMBL1800700 0.80 CYP3A4 (0.37) KMT2AMEN1POLB

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-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US claimed
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US claimed
US-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US disclosed
US-20070015784-A1 Subsitituted 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-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds SI, SSTR4, SLC10A2 PROKR1 322/4885KMT2A 4267/4885MEN1 1474/4885

“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.