SCHEMBL17559463

SCHEMBL17559463

NC[C@H](O)[C@H]1Cc2ccccc2CN1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.43
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
POLB P06746 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
DPP8 Q6V1X1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
PREP P48147 1/20 0.36

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
SCHEMBL19460804 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL17559433 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL17559368 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL19460646 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL19460801 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL17559486 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL17559367 1.00 ACE (0.43) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL25350020 0.87 ACE (0.44) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL25350023 0.87 ACE (0.44) ACEOPRM1OPRD1OPRK1POLB
SCHEMBL25355545 0.87 ACE (0.44) ACEOPRM1OPRD1OPRK1POLB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3189041-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-04-28 EP disclosed
US-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY. LTD. (AU) 2017-10-19 US disclosed
EP-3189041-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS Ctxt Pty Ltd (AU) 2017-07-12 EP disclosed
WO-2016034673-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2016-03-10 WO 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-20170298075-A1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS PRMT5, PRMT1, PRMT3 ACE 2484/4885OPRM1 1801/4885OPRD1 1573/4885

“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.