SCHEMBL10130962

SCHEMBL10130962

CCN1CC2CC2(c2ccc(N3CCN(S(=O)(=O)c4ccc(OC)cc4)CC3)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
LMNA P02545 1/20 0.60
TSHR P16473 1/20 0.60
PKM P14618 3/20 0.54
ALDH1A1 P00352 2/20 0.54
HSD11B1 P28845 1/20 0.53
THRB P10828 1/20 0.52
NPC1 O15118 1/20 0.48
PKLR P30613 1/20 0.48
RAB9A P51151 1/20 0.48
POLB P06746 3/20 0.48
MAPT P10636 4/20 0.47
ADORA2B P29275 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
KCNH2 Q12809 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 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
SCHEMBL10130959 0.89 MEN1 (0.57) SMN1; SMN2LMNATSHRPKMALDH1A1
SCHEMBL10130961 0.79 SMN1; SMN2 (0.63) SMN1; SMN2LMNATSHRPKMALDH1A1
SCHEMBL10130940 0.79 GAA (0.49) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL12974090 0.78 KCNH2 (0.41) SMN1; SMN2LMNATSHRMEN1KMT2A
SCHEMBL9951699 0.77 CHRNA7 (0.53) SMN1; SMN2MAPTDRD2DRD3KCNH2
SCHEMBL10130858 0.76 KCNH2 (0.47) SMN1; SMN2MAPTDRD2DRD3KCNH2
SCHEMBL10130862 0.76 KCNH2 (0.47) SMN1; SMN2MAPTDRD2DRD3KCNH2
SCHEMBL10130834 0.76 KCNH2 (0.47) SMN1; SMN2MAPTDRD2DRD3KCNH2
SCHEMBL10130859 0.76 KCNH2 (0.47) SMN1; SMN2MAPTDRD2DRD3KCNH2
SCHEMBL10132333 0.75 KCNH2 (0.47) SMN1; SMN2MAPTDRD2DRD3KCNH2

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
US-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 US disclosed
US-8906913-B2 Azabicyclohexanes PANACEA BIOTEC LIMITED (IN) 2014-12-09 US disclosed
EP-2445887-B1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD (IN) 2014-11-05 EP disclosed
US-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 US disclosed
US-20120165320-A1 NOVEL AZABICYCLOHEXANES PANACEA BIOTEC LTD. (IN) 2012-06-28 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-20120165320-A1 NOVEL AZABICYCLOHEXANES CYP3A43, UGT1A1, CYP3A4 SMN1; SMN2 3309/4885LMNA 3476/4885TSHR 2117/4885

“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.