SCHEMBL18965360

SCHEMBL18965360

CC(C)Cc1cn(-c2ccccc2)nn1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.62
MAOA P21397 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
GLA P06280 1/20 0.58
DRD2 P14416 2/20 0.56
DRD4 P21917 2/20 0.56
DRD3 P35462 2/20 0.56
DDX3X O00571 2/20 0.54
CD74 P04233 1/20 0.53
MIF P14174 1/20 0.53
NPC1 O15118 1/20 0.50
PIN1 Q13526 1/20 0.48
ESRRA P11474 1/20 0.48

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
SCHEMBL10447579 0.91 NOTUM (0.54) NOTUMMAOAL3MBTL1GLADDX3X
SCHEMBL15076068 0.84 L3MBTL1 (0.55) NOTUMMAOAL3MBTL1GLADRD2
SCHEMBL15075959 0.84 L3MBTL1 (0.55) NOTUMMAOAL3MBTL1GLADRD2
SCHEMBL15075954 0.84 L3MBTL1 (0.55) NOTUMMAOAL3MBTL1GLADRD2
SCHEMBL3777938 0.80 NOTUM (0.68) NOTUMMAOAL3MBTL1GLADRD2
SCHEMBL15316362 0.79 GLA (0.61) NOTUMMAOAL3MBTL1GLADRD2
Bromide SCHEMBL1882333 0.79 NOTUM (0.66) NOTUMMAOAL3MBTL1GLADRD2
SCHEMBL21787091 0.78 NOTUM (0.70) NOTUM
SCHEMBL14345608 0.77 AMY1A (0.50) NOTUMDDX3X
SCHEMBL16284862 0.77 NPC1 (0.52) NOTUMMAOAL3MBTL1GLADRD2

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
US-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF RADIONETICS ONCOLOGY, INC. 2024-07-11 US disclosed
US-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF RADIONETICS ONCOLOGY, INC. 2024-07-11 US disclosed
US-11826435-B2 Conduritol aziridine derivatives and uses thereof UNIVERSITY OF SASKATCHEWAN (CA) 2023-11-28 US disclosed
WO-2017100461-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING AN AUXILIARY MOIETY NON-BIOREVERSIBLY LINKED TO AN INTERNUCLEOSIDE PHOSPHATE OR PHOSPHOROTHIOATE SOLSTICE BIOLOGICS, LTD. (IE) 2017-06-15 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 (2 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-11826435-B2 Conduritol aziridine derivatives and uses thereof GAA, MAN2B1, GBA3 NOTUM 1059/4885MAOA 777/4885L3MBTL1 4857/4885
US-20240226343-A1 NEUROPEPTIDE Y1 RECEPTOR (NPY1R) TARGETED THERAPEUTICS AND USES THEREOF NPY1R, NPY2R, NPY4R NOTUM 4807/4885MAOA 1359/4885L3MBTL1 2541/4885

“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.