SCHEMBL7625875

SCHEMBL7625875

CCCC(C=CCCCCCCCCCCCCCCC(N)=O)CO

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
FAAH O00519 3/20 0.57
CYP1A2 P05177 3/20 0.57
CYP2C19 P33261 3/20 0.57
SOAT1 P35610 2/20 0.57
TP53 P04637 2/20 0.57
CYP3A4 P08684 1/20 0.57
KDM4E B2RXH2 2/20 0.53
CNR1 P21554 1/20 0.46
ALOX5 P09917 1/20 0.45
CETP P11597 5/20 0.45
THRB P10828 3/20 0.45
MAPT P10636 4/20 0.43
GMNN O75496 3/20 0.43
LMNA P02545 3/20 0.43
POLB P06746 3/20 0.43
BLM P54132 3/20 0.43
GLA P06280 2/20 0.43
MAPK1 P28482 2/20 0.43

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
SCHEMBL7624414 0.92 MEN1 (0.60) MEN1KMT2AFAAHCYP1A2CYP2C19
SCHEMBL7772727 0.91 MEN1 (0.57) MEN1KMT2AFAAHCYP1A2CYP2C19
SCHEMBL7625979 0.80 MEN1 (0.55) MEN1KMT2AFAAHCYP1A2CYP2C19
SCHEMBL7621398 0.80 MEN1 (0.55) MEN1KMT2AFAAHCYP1A2CYP2C19
SCHEMBL7622230 0.80 MEN1 (0.55) MEN1KMT2AFAAHCYP1A2CYP2C19
SCHEMBL21708352 0.79 ALOX5 (0.66) KMT2AFAAHCYP1A2CYP2C19ALOX5
SCHEMBL21708270 0.79 ALOX5 (0.66) KMT2AFAAHCYP1A2CYP2C19ALOX5
SCHEMBL20534392 0.79 ALOX5 (0.66) KMT2AFAAHCYP1A2CYP2C19ALOX5
SCHEMBL20535104 0.79 ALOX5 (0.66) KMT2AFAAHCYP1A2CYP2C19ALOX5
SCHEMBL28863748 0.79 ALOX5 (0.66) KMT2AFAAHCYP1A2CYP2C19ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6444832-B1 OSTEOPOROSIS ESSWEIN ANGELIKA (DE) 2002-09-03 US disclosed
EP-0865422-B1 USE OF AMINOALCOHOLDERIVATIVES AS DRUGS, DERIVATIVES AND PROCESS FOR THEIR PREPARATION ROCHE DIAGNOSTICS GMBH (DE) 2001-07-11 EP disclosed