SCHEMBL6601332

SCHEMBL6601332

CC(C)(C1CC1)N1CCN(C(=O)Cc2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
USP2 O75604 1/20 0.50
GAA P10253 1/20 0.50
TPSAB1 Q15661 1/20 0.48
TPSD1 Q9BZJ3 1/20 0.48
TPSG1 Q9NRR2 1/20 0.48
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.48
GPR183 P32249 3/20 0.48
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
POLB P06746 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 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
Hydrochloric Acid SCHEMBL4543073 0.99 SMN1; SMN2 (0.50) SMN1; SMN2USP2GAATPSAB1TPSD1
SCHEMBL13636244 0.90 FAAH (0.51) SMN1; SMN2USP2GAATPSAB1TPSD1
Hydrochloric Acid SCHEMBL4383032 0.89 FAAH (0.50) SMN1; SMN2USP2GAATPSAB1TPSD1
SCHEMBL13636026 0.87 HRH3 (0.57) SMN1; SMN2GAATPSAB1TPSD1TPSG1
Hydrochloric Acid SCHEMBL4393679 0.86 HRH3 (0.58) SMN1; SMN2GAATPSAB1TPSD1TPSG1
SCHEMBL13636028 0.79 POLB (0.56) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
Hydrochloric Acid SCHEMBL4380564 0.78 POLB (0.55) SMN1; SMN2ALDH1A1MAPTLMNAL3MBTL1
SCHEMBL16002988 0.77 EPHX2 (0.56) SMN1; SMN2USP2GAATPSAB1TPSD1
SCHEMBL16000498 0.75 ALDH1A1 (0.54) SMN1; SMN2USP2GAATPSAB1TPSD1
SCHEMBL19000972 0.74 HSD11B1 (0.65) SMN1; SMN2USP2GAAALDH1A1GPR183

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-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US disclosed
EP-1421071-A2 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS NOVO NORDISK A/S (DK) 2004-05-26 EP disclosed
WO-2003004480-A2 SUBSTITUTED PIPERAZINE AND DIAZEPANES AS HISTAMINE H3 RECEPTOR AGONISTS NOVO NORDISK A/S (DK) 2003-01-16 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-20080113968-A1 Substituted piperazines and diazepanes HRH3, HRH4, HRH1 SMN1; SMN2 2684/4885USP2 2350/4885GAA 2830/4885

“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.