SCHEMBL7620495

SCHEMBL7620495

CCCCCCCCC#CCCCCCCC(C(N)=O)C(CO)CCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.42
HMGCR P04035 3/20 0.42
RECQL P46063 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 2/20 0.37
POLB P06746 2/20 0.37
MAPT P10636 2/20 0.37
BLM P54132 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
MCL1 Q07820 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 2/20 0.37
CYP2D6 P10635 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36
GMNN O75496 1/20 0.36

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
SCHEMBL7624494 0.97 PTPN7 (0.39) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL7626038 0.94 HMGCR (0.46) PTPN7HMGCR
SCHEMBL7626532 0.91 PTPN7 (0.42) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL27468850 0.91 LMNA (0.44) KDM4EPOLBMAPTBLMLMNA
SCHEMBL7617672 0.91 LMNA (0.44) KDM4EPOLBMAPTBLMLMNA
SCHEMBL7624156 0.91 LMNA (0.44) KDM4EPOLBMAPTBLMLMNA
SCHEMBL7623699 0.91 LMNA (0.44) KDM4EPOLBMAPTBLMLMNA
SCHEMBL7620403 0.90 PTPN7 (0.41) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL7624535 0.84 CA2 (0.44) KDM4EPOLBMAPTBLMLMNA
SCHEMBL7618435 0.84 CA2 (0.44) KDM4EPOLBMAPTBLMLMNA

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
US-6444832-B1 OSTEOPOROSIS ESSWEIN ANGELIKA (DE) 2002-09-03 US disclosed