SCHEMBL1800768

SCHEMBL1800768

CCC(C(=O)O)N1C(=O)C(Cc2ccccc2)NC12CCN(C(=O)c1ccc(-c3ccccc3)cc1)CC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 4/20 0.42
TSHR P16473 4/20 0.42
POLB P06746 2/20 0.41
MAPK1 P28482 2/20 0.40
HPGD P15428 1/20 0.40
FASN P49327 4/20 0.40
HTR1A P08908 1/20 0.40
HTR1B P28222 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
USP2 O75604 1/20 0.38

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
SCHEMBL1807036 0.89 NPC1 (0.46) LMNATSHRHPGD
SCHEMBL1800404 0.89 CA1 (0.52)
SCHEMBL1801112 0.89 CRBN (0.45) KMT2ATSHRPOLBMAPTNPSR1
SCHEMBL1801910 0.88 KMT2A (0.44) KMT2AMEN1LMNATSHRPOLB
SCHEMBL1798648 0.87 MGLL (0.42) KMT2AMEN1TSHRMAPK1HPGD
SCHEMBL1801220 0.85 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL1800448 0.85 KMT2A (0.40) KMT2AMEN1TSHRMAPK1CYP2D6
SCHEMBL1801813 0.84 CYP2C9 (0.49) KMT2AMEN1LMNATSHRHTR2B
SCHEMBL1802355 0.84 CYP3A4 (0.55) LMNAPOLBHPGDALDH1A1SMN1; SMN2
SCHEMBL1796900 0.84 CYP3A4 (0.39) TSHRMAPK1ALDH1A1SMN1; SMN2USP2

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 KMT2A 4267/4885MEN1 1474/4885LMNA 3374/4885

“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.