SCHEMBL21780197

SCHEMBL21780197

CCCCCCC[C@@H](C)NC(C)C

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.54
ADH1C P00326 1/20 0.54
ADH1A P07327 1/20 0.54
ADH4 P08319 1/20 0.54
ADH7 P40394 1/20 0.54
OPRM1 P35372 1/20 0.44
SPHK1 Q9NYA1 1/20 0.41
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
MEN1 O00255 1/20 0.39
FAAH O00519 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
ACE2 Q9BYF1 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
FDPS P14324 3/20 0.37
FFAR1 O14842 1/20 0.37

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
SCHEMBL7776746 1.00 ADH1B (0.54) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10464716 0.97 ADH1B (0.50) ADH1BADH1CADH1AADH4ADH7
SCHEMBL4603730 0.90 ADH1B (0.58) ADH1BADH1CADH1AADH4ADH7
SCHEMBL16223598 0.90 ADH1B (0.58) ADH1BADH1CADH1AADH4ADH7
SCHEMBL4660468 0.90 ADH1B (0.58) ADH1BADH1CADH1AADH4ADH7
SCHEMBL23902076 0.90 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL12201612 0.90 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL570864 0.90 ADH1B (0.58) ADH1BADH1CADH1AADH4ADH7
SCHEMBL10952637 0.90 ADH1B (0.41) ADH1BADH1CADH1AADH4ADH7
SCHEMBL14142731 0.90 ADH1B (0.58) ADH1BADH1CADH1AADH4ADH7

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
EP-3617313-A1 ANTIGEN-BINDING MOLECULE FOR PROMOTING CLEARANCE FROM PLASMA OF ANTIGEN COMPRISING SACCHARIDE CHAIN RECEPTOR-BINDING DOMAIN Chugai Seiyaku Kabushiki Kaisha (JP) 2020-03-04 EP disclosed