SCHEMBL13137656

SCHEMBL13137656

CCCNC(C)c1ccc(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
TP53 P04637 2/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
POLB P06746 2/20 0.44
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 1/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
GPR139 Q6DWJ6 1/20 0.37

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
SCHEMBL12812113 0.86 TDP1 (0.41) LMNATP53HTTRAB9AMEN1
SCHEMBL13627131 0.86 LMNA (0.53) LMNATP53HTTRAB9AMEN1
SCHEMBL13267555 0.86 LMNA (0.53) LMNATP53HTTRAB9AMEN1
SCHEMBL8196834 0.82 MEN1 (0.52) LMNATP53HTTRAB9AMEN1
SCHEMBL24762848 0.80 LMNA (0.47) LMNATP53HTTRAB9AMEN1
SCHEMBL13137655 0.79 ADRB2 (0.49) LMNAHTTMEN1KMT2APOLB
SCHEMBL8210156 0.77 LMNA (0.67) LMNATP53HTTRAB9AMEN1
SCHEMBL1436122 0.77 RAB9A (0.46) LMNATP53HTTRAB9AMEN1
SCHEMBL19965517 0.76 LMNA (0.59) LMNATP53HTTRAB9AMEN1
SCHEMBL8353840 0.76 LMNA (0.59) LMNATP53HTTRAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816408-B2 Calcium receptor active compounds NPS PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20090176993-A1 Calcium receptor active compounds NPS PHARMACEUTICALS, INC. 2009-07-09 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-20090176993-A1 Calcium receptor active compounds CASR, CALCR, CACNA1E LMNA 4836/4885TP53 4031/4885HTT 3454/4885

“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.