SCHEMBL17198262

SCHEMBL17198262

CC(C)CCCC(C)NC(P)P

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
BLM P54132 1/20 0.31

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
SCHEMBL277041 0.84 LMNA (0.50) LMNAMEN1ALDH1A1HTTKMT2A
Iproheptine SCHEMBL48719 0.79 LMNA (0.46) LMNAMEN1ALDH1A1HTTKMT2A
Iproheptine SCHEMBL23902081 0.79 LMNA (0.46) LMNAMEN1ALDH1A1HTTKMT2A
Iproheptine SCHEMBL18541892 0.79 LMNA (0.46) LMNAMEN1ALDH1A1HTTKMT2A
Iproheptine SCHEMBL616269 0.77 LMNA (0.43) LMNAMEN1ALDH1A1HTTKMT2A
SCHEMBL16469538 0.71
SCHEMBL42290 0.71
SCHEMBL19123140 0.70 LMNA (0.48) LMNAMEN1ALDH1A1HTTKMT2A
SCHEMBL14450809 0.70 LMNA (0.48) LMNAMEN1ALDH1A1HTTKMT2A
SCHEMBL17887637 0.70 LMNA (0.48) LMNAMEN1ALDH1A1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015159153-A1 NOVEL BISPHOSPHONATES AND THEIR USE WROCŁAWSKIE CENTRUM BADAŃ EIT+ SP. Z O.O. (PL) 2015-10-22 WO disclosed