SCHEMBL276899

SCHEMBL276899

CC(C)c1ccc(N2C[C@@H](C)O[C@@H](C)C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
MAPK1 P28482 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
RAB9A P51151 2/20 0.44
KMT2A Q03164 4/20 0.44
KDM4E B2RXH2 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
ALDH1A1 P00352 5/20 0.43
TSHR P16473 1/20 0.42
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.39
MGLL Q99685 1/20 0.39
LMNA P02545 1/20 0.38
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
CDK6 Q00534 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
SCHEMBL24352440 1.00 MAPT (0.53) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL18068289 1.00 MAPT (0.53) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL24352441 1.00 MAPT (0.53) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL21388675 0.86 MAPT (0.50) MAPTMAPK1RAB9AKMT2AKDM4E
Hydrochloric Acid SCHEMBL21378608 0.84 MAPT (0.49) MAPTMAPK1RAB9AKMT2AKDM4E
Hydrochloric Acid SCHEMBL21378610 0.84 MAPT (0.49) MAPTMAPK1RAB9AKMT2AKDM4E
SCHEMBL19012758 0.83 MAPT (0.43) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL19012383 0.83 MAPT (0.43) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL13370273 0.81 MAPT (0.56) MAPTMAPK1L3MBTL1RAB9AKMT2A
SCHEMBL13144984 0.81 MAPT (0.56) MAPTMAPK1L3MBTL1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE HALIA THERAPEUTICS INC (US) 2023-06-15 US disclosed
US-11578061-B2 Inhibitors of LRRK2 kinase Halia Therapeutics, Inc. (US) 2023-02-14 US disclosed
US-20220119395-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-04-21 US disclosed
US-20190233417-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-08-01 US disclosed
US-20160096834-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-04-07 US disclosed
US-8133513-B2 Solid preparation having improved solubility SHIONOGI & CO., LTD. (JP) 2012-03-13 US disclosed
US-20100240711-A1 SOLID PREPARATION COMPRISING NPYY5 RECEPTOR ANTAGONIST SHIONOGI & CO., LTD. (JP) 2010-09-23 US disclosed
US-20090105312-A1 SOLID PREPARATION HAVING IMPROVED SOLUBILITY SHIONOGI & CO., LTD. (JP) 2009-04-23 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 (7 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-20220119395-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 MAPT 1168/4885MAPK1 2112/4885L3MBTL1 4572/4885
US-20190233417-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF BTK, SYK, LYN MAPT 4313/4885MAPK1 1065/4885L3MBTL1 1551/4885
US-20160096834-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF BTK, SYK, LYN MAPT 4172/4885MAPK1 1046/4885L3MBTL1 1862/4885
US-20230183217-A1 INHIBITORS OF LRRK2 KINASE LRRK2, SNCA, PRKAR2B MAPT 422/4885MAPK1 48/4885L3MBTL1 241/4885
US-11578061-B2 Inhibitors of LRRK2 kinase LRRK2, SNCA, PRKAR2B MAPT 422/4885MAPK1 48/4885L3MBTL1 241/4885
US-20090105312-A1 SOLID PREPARATION HAVING IMPROVED SOLUBILITY NUDT1, PDE7A, SLC7A1 MAPT 235/4885MAPK1 2335/4885L3MBTL1 4813/4885
US-20100240711-A1 SOLID PREPARATION COMPRISING NPYY5 RECEPTOR ANTAGONIST NPY5R, SSTR5, NPY1R MAPT 553/4885MAPK1 1713/4885L3MBTL1 4868/4885

“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.