SCHEMBL23680898

SCHEMBL23680898

CC1(c2ccc(-n3ccc4cc(C(=O)N5CCC(F)(F)CC5)cnc43)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.55
MGLL Q99685 1/20 0.47
VNN1 O95497 1/20 0.40
LRRK2 Q5S007 1/20 0.38
ADRA1A P35348 2/20 0.36
DDR1 Q08345 3/20 0.36
GABRA5 P31644 1/20 0.35
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
HTR1A P08908 1/20 0.34
SCN9A Q15858 1/20 0.34

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
SCHEMBL24463716 0.90 HPGD (0.56) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL23675335 0.88 HPGD (0.51) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL23675201 0.88 HPGD (0.54) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL23680616 0.88 HPGD (0.61) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL24329043 0.88 HPGD (0.54) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL29565750 0.87 HPGD (0.54) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL23680713 0.87 HPGD (0.53) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL23675180 0.86 HPGD (0.58) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL24463672 0.86 HPGD (0.52) HPGDMGLLVNN1LRRK2ADRA1A
SCHEMBL24942618 0.86 HPGD (0.55) HPGDMGLLVNN1LRRK2ADRA1A

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
WO-2021151014-A1 PGDH INHIBITORS AND METHODS OF MAKING AND USING MYOFORTE THERAPEUTICS, INC. (US) 2021-07-29 WO disclosed