SCHEMBL19333354

SCHEMBL19333354

CCC(C)N(CCOC)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
HSD17B10 Q99714 1/20 0.33
ADH1A P07327 4/20 0.33
PIK3CD O00329 1/20 0.32
SHBG P04278 1/20 0.31
ADH1C P00326 3/20 0.31
ADH1B P00325 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
SCHEMBL17914504 0.84 ADH1A (0.37) ADH1APIK3CDADH1CADH1B
SCHEMBL104717 0.82 PIK3CD (0.36) ADH1APIK3CDADH1CADH1B
SCHEMBL19333315 0.82 ADH1A (0.44) KMT2AMEN1HSD17B10ADH1ASHBG
SCHEMBL14398636 0.79 KMT2A (0.35) KMT2AMEN1HSD17B10ADH1ASHBG
SCHEMBL23319725 0.74 SHBG (0.35) KMT2AMEN1HSD17B10ADH1ASHBG
SCHEMBL21030401 0.74 PIK3CD (0.39) PIK3CD
SCHEMBL23319709 0.72 SHBG (0.32) KMT2AADH1ASHBGADH1CADH1B
SCHEMBL14199751 0.71 ADH1A (0.35) KMT2AMEN1ADH1APIK3CDADH1C
SCHEMBL22200610 0.71 SLC6A2 (0.37) KMT2AMEN1ADH1APIK3CDADH1C
SCHEMBL24693895 0.71 DRD2 (0.33) ADH1AADH1C

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-9758492-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-12 US disclosed