SCHEMBL1624610

SCHEMBL1624610

CN1CCN(C(=O)C2CCCN(c3ccc(Cl)c(-c4nc5ccccc5[nH]4)c3)C2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
BRD4 O60885 1/20 0.46
DGAT2 Q96PD7 8/20 0.45
TP53 P04637 2/20 0.43
MAPT P10636 1/20 0.43
HRH4 Q9H3N8 1/20 0.42
NOTUM Q6P988 1/20 0.42
PDGFRB P09619 1/20 0.42
FGFR1 P11362 1/20 0.42
KDR P35968 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL1625277 1.00 LMNA (0.47) LMNABRD4DGAT2TP53MAPT
SCHEMBL1624968 1.00 LMNA (0.47) LMNABRD4DGAT2TP53MAPT
SCHEMBL1624332 0.98 LMNA (0.46) LMNABRD4DGAT2TP53MAPT
SCHEMBL1624779 0.95 LMNA (0.53) LMNABRD4TP53MAPTHRH4
SCHEMBL1284559 0.93 DGAT2 (0.51) LMNADGAT2NOTUM
SCHEMBL1284557 0.93 DGAT2 (0.51) LMNADGAT2NOTUM
SCHEMBL1624583 0.93 DGAT2 (0.51) LMNADGAT2NOTUM
SCHEMBL1622860 0.92 DGAT2 (0.51) LMNADGAT2NOTUM
SCHEMBL13033835 0.92 BRD4 (0.49) LMNABRD4TP53MAPTHRH4
SCHEMBL1625615 0.91 LMNA (0.46) LMNADGAT2TP53MAPTNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835648-B2 Hedgehog pathway antagonists and therapeutic applications thereof SIENA BIOTECH S.P.A. (IT) 2014-09-16 US disclosed
US-8835648-B2 Hedgehog pathway antagonists and therapeutic applications thereof SIENA BIOTECH S.P.A. (IT) 2014-09-16 US disclosed
US-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2012-04-12 US disclosed
US-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2012-04-12 US disclosed
US-20100286114-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2010-11-11 US disclosed
US-20100286114-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2010-11-11 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 (2 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-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SHH, GLI1, SMO LMNA 4481/4885BRD4 458/4885DGAT2 719/4885
US-20100286114-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SHH, GLI1, SMO LMNA 4481/4885BRD4 458/4885DGAT2 719/4885

“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.