SCHEMBL5226319

SCHEMBL5226319

Cc1nc(-c2ccc(-c3ccc(CN(C)Cc4cccs4)cc3)cc2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
RAB9A P51151 3/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
NFKB1 P19838 1/20 0.43
MAPK1 P28482 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
RBP1 P09455 1/20 0.41
TSHR P16473 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CA12 O43570 2/20 0.39

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
SCHEMBL5224485 0.80 NPC1 (0.46) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5225893 0.79 HRH3 (0.55) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5226025 0.78 NPC1 (0.53) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5223185 0.76 NPC1 (0.45) NPC1L3MBTL1RAB9AALDH1A1MAPK1
SCHEMBL5226114 0.75 NPC1 (0.49) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5224075 0.75 NPC1 (0.43) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5224688 0.74 NPC1 (0.45) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5223287 0.74 NPC1 (0.45) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5223372 0.74 NPC1 (0.38) NPC1L3MBTL1RAB9AALDH1A1LMNA
SCHEMBL5226306 0.73 RAB9A (0.43) NPC1L3MBTL1RAB9ACASP3SENP8

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 NPC1 616/4885L3MBTL1 4112/4885RAB9A 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.