SCHEMBL21140559

SCHEMBL21140559

CNc1cncc(OC2CCN(S(C)(=O)=O)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.46
CYP2D6 P10635 1/20 0.46
TDO2 P48775 2/20 0.42
IDO1 P14902 1/20 0.42
RORC P51449 4/20 0.41
ALDH1A1 P00352 4/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NAMPT P43490 1/20 0.39
EGFR P00533 1/20 0.38

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
SCHEMBL15829428 0.83 HRH3 (0.48) HRH3CYP2D6TDO2IDO1RORC
SCHEMBL16220941 0.80 HRH3 (0.46) HRH3CYP2D6RORCALDH1A1NPC1
SCHEMBL19633902 0.80 HRH3 (0.46) HRH3CYP2D6RORCALDH1A1L3MBTL1
SCHEMBL16217399 0.80 HRH3 (0.46) HRH3CYP2D6TDO2IDO1RORC
SCHEMBL4883637 0.70 PDE4A (0.49) HRH3CYP2D6RORCALDH1A1NPC1
SCHEMBL15829990 0.69 FPR2 (0.59) HRH3CYP2D6RORCALDH1A1MAPT
SCHEMBL16038107 0.69 HRH3 (0.56) HRH3CYP2D6RORCMAPTSMN1; SMN2
SCHEMBL15261932 0.69 HRH3 (0.50) HRH3CYP2D6RORCNPC1RAB9A
SCHEMBL15772392 0.68 HRH3 (0.50) HRH3CYP2D6RORCMAPTSMN1; SMN2
SCHEMBL18183745 0.68 HRH3 (0.55) HRH3CYP2D6RORCMAPTSMN1; SMN2

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-4219465-A2 PRMT5 INHIBITORS AND USES THEREOF Epizyme Inc (US) 2023-08-02 EP disclosed
EP-3498701-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme Inc (US) 2019-06-19 EP disclosed