SCHEMBL1790282

SCHEMBL1790282

CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)N3CCOCC3)cc2CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
USP2 O75604 1/20 0.52
KMT2A Q03164 1/20 0.51
ESR2 Q92731 1/20 0.50
NR1H2 P55055 1/20 0.49
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 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
SCHEMBL1787312 0.89 MEN1 (0.51) HTTSMN1; SMN2USP2KMT2AESR2
SCHEMBL1787313 0.81 ESR2 (0.59) SMN1; SMN2USP2KMT2AESR2NR1H2
SCHEMBL12651589 0.81 KMT2A (0.63) HTTSMN1; SMN2KMT2AMAPTNPC1
SCHEMBL1788257 0.80 ESR2 (0.57) SMN1; SMN2USP2KMT2AESR2NR1H2
SCHEMBL12651590 0.80 KMT2A (0.63) HTTSMN1; SMN2KMT2AMAPT
SCHEMBL7949290 0.78 KMT2A (0.60) HTTSMN1; SMN2KMT2AMAPT
SCHEMBL4764988 0.78 NPC1 (0.59) SMN1; SMN2USP2KMT2AESR2NR1H2
Hydrochloric Acid SCHEMBL1788931 0.77 KMT2A (0.59) HTTSMN1; SMN2KMT2AMAPT
SCHEMBL16645176 0.77 ESR2 (0.55) SMN1; SMN2USP2KMT2AESR2NR1H2
SCHEMBL14812959 0.77 NR1H2 (0.66) KMT2AESR2NR1H2NPC1RAB9A

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-2326625-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS Takeda Pharmaceutical Company Limited (JP) 2011-06-01 EP disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 WO disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 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-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS HRH4, HRH3, HRH2 HTT 2116/4885SMN1; SMN2 4393/4885USP2 2899/4885

“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.