SCHEMBL21358355

SCHEMBL21358355

CON(C)C(=O)c1ccccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP3A4 P08684 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
MLYCD O95822 1/20 0.40
KDM4E B2RXH2 3/20 0.36
KAT6A Q92794 1/20 0.36
DRD2 P14416 3/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CYP2C9 P11712 1/20 0.35
MAOB P27338 1/20 0.35
DRD1 P21728 1/20 0.35
DRD5 P21918 1/20 0.35

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
SCHEMBL14438169 0.81 MAPT (0.50) L3MBTL1MAPTHPGD
SCHEMBL14893567 0.80 KCNK3 (0.49) L3MBTL1MLYCD
SCHEMBL4442981 0.80 L3MBTL1 (0.61) L3MBTL1MAPTCYP1A2CYP2C19POLB
SCHEMBL1648325 0.79 KDM4E (0.49) L3MBTL1MAPTCYP1A2MEN1KMT2A
SCHEMBL1902043 0.79 ELANE (0.46) L3MBTL1MAPTCYP1A2CYP2C19CYP3A4
SCHEMBL307126 0.77 CTSD (0.51) L3MBTL1NPC1RAB9AHPGDHTT
SCHEMBL21358396 0.76 MLYCD (0.42) MLYCDRAB9AHTT
SCHEMBL3653595 0.76 CTNNB1 (0.53) L3MBTL1MAPTCYP3A4MEN1KMT2A
SCHEMBL21358357 0.75 MLYCD (0.56) MAPTMEN1KMT2AMLYCDKDM4E
SCHEMBL14065615 0.75 ABCB1 (0.45) L3MBTL1MAPTMEN1POLBKMT2A

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
EP-3765020-A1 SPIROCYCLIC ROR-GAMMA MODULATORS Escalier Biosciences B.V. (US) 2021-01-20 EP disclosed
WO-2019177997-A1 SPIROCYCLIC ROR-GAMMA MODULATORS ESCALIER BIOSCIENCES B.V. (US) 2019-09-19 WO disclosed