SCHEMBL12697443

SCHEMBL12697443

O=C(c1cnc(Cl)c2cccc(Cl)c12)N1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.52
NPC1 O15118 2/20 0.52
GLA P06280 1/20 0.52
LMNA P02545 4/20 0.47
TP53 P04637 2/20 0.47
HTT P42858 2/20 0.44
XBP1 P17861 1/20 0.44
HIF1A Q16665 1/20 0.44
RAB9A P51151 1/20 0.44
CNR2 P34972 3/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
CNR1 P21554 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
HSP90AA1 P07900 1/20 0.43

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
SCHEMBL12476721 0.87 KDM4E (0.50) HPGDLMNATP53HTTCNR2
SCHEMBL12697356 0.87 CNR2 (0.49) HPGDNPC1GLALMNATP53
SCHEMBL12697435 0.86 CNR2 (0.48) HPGDNPC1GLALMNATP53
SCHEMBL12697375 0.85 TSHR (0.51) HPGDNPC1GLALMNATP53
SCHEMBL12477130 0.84 LMNA (0.43) HPGDNPC1GLALMNATP53
SCHEMBL12475971 0.83 HTT (0.50) HPGDLMNATP53HTTCNR2
SCHEMBL12477081 0.79 CNR2 (0.66) NPC1LMNATP53RAB9ACNR2
SCHEMBL12476387 0.77 HPGD (0.46) HPGDNPC1GLALMNATP53
SCHEMBL12476737 0.76 CNR2 (0.47) HPGDNPC1RAB9ACNR2KDM4E
SCHEMBL14485972 0.76 DHODH (0.50) HPGDNPC1LMNATP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006442-B2 Cannabinoid receptor modulators LUPIN LIMITED (IN) 2015-04-14 US disclosed
US-9006442-B2 Cannabinoid receptor modulators LUPIN LIMITED (IN) 2015-04-14 US disclosed
US-9006442-B2 Cannabinoid receptor modulators LUPIN LIMITED (IN) 2015-04-14 US disclosed
US-20130178457-A1 CANNABINOID RECEPTOR MODULATORS LUPIN LIMITED (IN) 2013-07-11 US disclosed
US-20130178457-A1 CANNABINOID RECEPTOR MODULATORS LUPIN LIMITED (IN) 2013-07-11 US disclosed
US-20130178457-A1 CANNABINOID RECEPTOR MODULATORS LUPIN LIMITED (IN) 2013-07-11 US disclosed
WO-2013005168-A2 CANNABINOID RECEPTOR MODULATORS LUPIN LIMITED (IN) 2013-01-10 WO disclosed
WO-2012090177-A2 CANNABINOID RECEPTOR MODULATORS LUPIN LIMITED (IN) 2012-07-05 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-20130178457-A1 CANNABINOID RECEPTOR MODULATORS CNR1, CNR2, GPR18 HPGD 1267/4885NPC1 289/4885GLA 2909/4885

“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.