SCHEMBL4604002

SCHEMBL4604002

COCCn1cc(C)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.55
CNR1 P21554 4/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PRKACA P17612 2/20 0.47
PRKACG P22612 2/20 0.47
PRKACB P22694 2/20 0.47
ALDH1A1 P00352 1/20 0.47
NR2F2 P24468 1/20 0.47
GSK3B P49841 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46

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
SCHEMBL90184 0.90 CNR2 (0.56) CNR2CNR1NPSR1MEN1KMT2A
SCHEMBL24199359 0.87 CNR2 (0.53) CNR2CNR1NPSR1PRKACAPRKACG
SCHEMBL4603995 0.81 NPSR1 (0.57) CNR2CNR1NPSR1PRKACAPRKACG
SCHEMBL27462617 0.81 POLB (0.51) MEN1KMT2AALDH1A1NR2F2HDAC1
SCHEMBL8612793 0.80 CNR2 (0.56) CNR2CNR1MEN1KMT2AALDH1A1
SCHEMBL20221429 0.80 MEN1 (0.53) CNR2CNR1MEN1KMT2AALDH1A1
SCHEMBL13490778 0.80 CNR2 (0.56) CNR2CNR1NPSR1MEN1KMT2A
SCHEMBL4617648 0.79 CNR2 (0.51) CNR2CNR1NPSR1PRKACAPRKACG
SCHEMBL11622484 0.79 MEN1 (0.55) CNR2CNR1MEN1KMT2AALDH1A1
SCHEMBL20054193 0.79 MEN1 (0.51) CNR2CNR1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1915366-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS Novartis AG (CH) 2008-04-30 EP claimed
WO-2006128659-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS. NOVARTIS AG (CH) 2006-12-07 WO claimed
US-20080242662-A1 Organic Compounds NIHONYANAGI ATSUKO 2008-10-02 US disclosed
EP-1915366-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS Novartis AG (CH) 2008-04-30 EP disclosed
WO-2006128659-A2 PIPERAZINE DERIVATIVE RENIN INHIBITORS. NOVARTIS AG (CH) 2006-12-07 WO 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-20080242662-A1 Organic Compounds REN, ACE, ECE1 CNR2 1043/4885CNR1 506/4885NPSR1 1153/4885

“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.