SCHEMBL7849634

SCHEMBL7849634

c1cc2c(cc1CN1CCOCC1)C[C@]1(CCN3CCCC[C@H]3C1)O2

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.44
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL7856898 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL7856596 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL863954 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL7849312 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL10191845 1.00 HRH3 (0.44) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL864809 0.97 HRH3 (0.45) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL863321 0.96 HRH3 (0.40) HRH3KDM4ESMN1; SMN2KMT2ANPC1
SCHEMBL10192274 0.93 MEN1 (0.43) HRH3SMN1; SMN2KMT2AMEN1L3MBTL3
SCHEMBL863829 0.92 HRH3 (0.46) HRH3SMN1; SMN2KMT2AMEN1L3MBTL3
SCHEMBL10192272 0.91 MEN1 (0.43) HRH3SMN1; SMN2KMT2AMEN1L3MBTL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
WO-2010144571-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SEPRACOR INC. (US) 2010-12-16 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-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF HRH3, HRH4, HRH2 HRH3 1/4885KDM4E 2281/4885SMN1; SMN2 1663/4885

“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.