SCHEMBL5375882

SCHEMBL5375882

Cc1ccc(-c2ccc(-c3cn4c(n3)CCC(C(N)=O)C4)c(C)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
WDR5 P61964 7/20 0.36
S1PR1 P21453 1/20 0.36
S1PR5 Q9H228 1/20 0.36
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 1/20 0.34
HDAC2 Q92769 1/20 0.34
LRRK2 Q5S007 1/20 0.33
EIF2AK4 Q9P2K8 1/20 0.33
SIRT1 Q96EB6 1/20 0.33

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
SCHEMBL5311345 0.86 WDR5 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5375885 0.81 LMNA (0.42) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5367755 0.79 WDR5 (0.38) ALDH1A1LMNAWDR5LRRK2
SCHEMBL18281466 0.77 MAPK14 (0.36) ALDH1A1LMNAWDR5KDM4EHPGD
SCHEMBL18281430 0.68 MAPK14 (0.46) NPC1RAB9AALDH1A1LMNAWDR5
Acetic Acid SCHEMBL4951340 0.67 NQO2 (0.40) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
Acetic Acid SCHEMBL4952218 0.67 ITGB3 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5308583 0.66 LMNA (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5306345 0.66 LMNA (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL5363983 0.66 MAPT (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1LMNA

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
WO-2007034282-A2 DIARYL-IMIDAZOLE COMPOUNDS CONDENSED WITH A HETEROCYCLE AS C3A RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2007-03-29 WO claimed
EP-3302710-A1 MOBILIZING AGENTS AND USES THEREFOR The University of Queensland (AU) 2018-04-11 EP disclosed
WO-2016191811-A1 MOBILIZING AGENTS AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2016-12-08 WO disclosed