SCHEMBL24378399

SCHEMBL24378399

CCCCCCCCCC(CCN)N(CCCCC)C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 2/20 0.34
ADH1C P00326 1/20 0.34
ADH4 P08319 1/20 0.34
PLA2G1B P04054 1/20 0.33
PLA2G2A P14555 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 2/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
SPHK1 Q9NYA1 1/20 0.31
DNM1 Q05193 4/20 0.31
MEN1 O00255 1/20 0.31
TSHR P16473 1/20 0.31
EPHX1 P07099 1/20 0.31
CYP1A2 P05177 1/20 0.30

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
SCHEMBL10710852 0.86 ADH1A (0.39) ADH1AADH1CADH4THRATHRB
SCHEMBL28083249 0.74 ADH1A (0.39) ADH1AADH1CADH4THRATHRB
SCHEMBL13464074 0.73 THRA (0.39) ADH1AADH1CADH4THRATHRB
SCHEMBL13463929 0.73 THRA (0.39) ADH1AADH1CADH4THRATHRB
SCHEMBL13463996 0.73 THRA (0.35) ADH1AADH1CTHRATHRBCYP1A2
SCHEMBL22201718 0.71 SLC2A1 (0.38) ADH1AADH1CEPHX1
SCHEMBL28049351 0.70 NAAA (0.35) ADH1AADH1CADH4THRATHRB
SCHEMBL7609404 0.69 ADH1A (0.43) ADH1AADH1CADH4THRATHRB
SCHEMBL39288 0.69 ADH1A (0.40) ADH1AADH1CADH4ALDH1A1KMT2A
SCHEMBL16949691 0.69 ADH1A (0.43) ADH1AADH1CADH4THRATHRB

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-3988920-A1 METHODS, KITS AND APPARATUS FOR EXPANDING A POPULATION OF CELLS Juno Therapeutics GmbH (DE) 2022-04-27 EP disclosed