SCHEMBL19633902

SCHEMBL19633902

CC(C)c1cncc(OC2CCN(S(C)(=O)=O)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.46
CYP2D6 P10635 1/20 0.46
RORC P51449 12/20 0.45
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RORA P35398 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NAAA Q02083 1/20 0.39
F10 P00742 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
F7 P08709 1/20 0.39
F3 P13726 1/20 0.39
PRSS3 P35030 1/20 0.39
FPR2 P25090 1/20 0.39
PROKR1 Q8TCW9 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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) HRH3CYP2D6RORCMEN1KMT2A
SCHEMBL19287832 0.82 TGFBR1 (0.43) HRH3CYP2D6SMN1; SMN2
SCHEMBL799382 0.82 CHRNB2 (0.39)
SCHEMBL19171114 0.80 MEN1 (0.53) HRH3CYP2D6RORCMEN1KMT2A
SCHEMBL19633721 0.80 CYP11B2 (0.53)
SCHEMBL16220941 0.80 HRH3 (0.46) HRH3CYP2D6RORCMEN1KMT2A
SCHEMBL16217399 0.80 HRH3 (0.46) HRH3CYP2D6RORCMEN1KMT2A
SCHEMBL21140559 0.80 HRH3 (0.46) HRH3CYP2D6RORCALDH1A1L3MBTL1
SCHEMBL12120787 0.77 RORC (0.45) HRH3CYP2D6RORCRORAF10
SCHEMBL19633739 0.74 MEN1 (0.45) RORCMEN1KMT2A

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
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2017-11-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170334861-A1 TETRAHYDRO- AND DIHYDRO-ISOQUINOLINE PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT3 HRH3 629/4885CYP2D6 1964/4885RORC 971/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.