SCHEMBL5224880

SCHEMBL5224880

Cc1nc(-c2ccc(-c3ccc(CN4CCOCC4)cc3)cc2)no1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.62
NPC1 O15118 4/20 0.62
RAB9A P51151 4/20 0.62
HRH3 Q9Y5N1 2/20 0.62
ALDH1A1 P00352 3/20 0.59
TSHR P16473 2/20 0.53
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 2/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
HDAC4 P56524 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
KCNH2 Q12809 3/20 0.48
CYP2D6 P10635 1/20 0.48
S1PR1 P21453 1/20 0.46
GPR119 Q8TDV5 1/20 0.46
JAK2 O60674 1/20 0.45

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
SCHEMBL5228387 0.89 RAB9A (0.51) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5225958 0.89 SMN1; SMN2 (0.59) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5224061 0.88 NPC1 (0.49) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5225149 0.88 SMN1; SMN2 (0.61) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL28957460 0.86 SMN1; SMN2 (0.63) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5220653 0.85 RAB9A (0.46) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5220668 0.85 RAB9A (0.46) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5223197 0.84 SMN1; SMN2 (0.53) SMN1; SMN2NPC1RAB9AALDH1A1TSHR
SCHEMBL7070577 0.84 SMN1; SMN2 (0.52) SMN1; SMN2NPC1RAB9AHRH3ALDH1A1
SCHEMBL5221962 0.83 ALDH1A1 (0.63) SMN1; SMN2ALDH1A1TSHRMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060019998-A1 Histamine-3 receptor antagonist PFIZER INC 2006-01-26 US claimed
EP-1771449-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-04-11 EP disclosed
WO-2006011043-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-02-02 WO disclosed
US-20060019998-A1 Histamine-3 receptor antagonist PFIZER INC 2006-01-26 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-20060019998-A1 Histamine-3 receptor antagonist HRH3, HRH4, HRH2 SMN1; SMN2 1870/4885NPC1 616/4885RAB9A 295/4885

“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.