SCHEMBL30200324

SCHEMBL30200324

CN1CC(NC(=O)c2ccccc2F)C1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
NPC1 O15118 3/20 0.51
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.48
ALOX12 P18054 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
RAB9A P51151 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
GRM5 P41594 1/20 0.47
KDM5A P29375 1/20 0.47
CCR3 P51677 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL31188531 0.88 NPC1 (0.56) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL31188489 0.88 NPC1 (0.56) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL21779907 0.84 GAA (0.50) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL13161963 0.83 NPC1 (0.65) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL363351 0.82 NPC1 (0.60) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL29860179 0.81 TP53 (0.56) GAA
SCHEMBL3533984 0.80 GAA (0.68) GAAKMT2AMEN1ALDH1A1
SCHEMBL10278648 0.79 GRM5 (0.64) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL28465600 0.79 NPC1 (0.66) GAANPC1KMT2AMEN1ALDH1A1
SCHEMBL29242230 0.78 USP30 (0.55) GAANPC1POLBKDM5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112533904-B Melanocortin subtype-2 receptor (MC 2R) antagonists and uses thereof 克林提克斯医药股份有限公司 2024-10-29 CN claimed
US-20240132492-A1 PYRIDOPYRIMIDINE-BASED COMPOUND AND APPLICATION THEREOF JINAN UNIVERSITY (CN) 2024-04-25 US disclosed
CN-115348963-B Pyridopyrimidine compound and application thereof 暨南大学 2024-04-19 CN disclosed
EP-4310084-A1 PYRIDOPYRIMIDINE-BASED COMPOUND AND APPLICATION THEREOF Jinan University (CN) 2024-01-24 EP disclosed
CN-115348963-A Pyridopyrimidine compound and application thereof 暨南大学 2022-11-15 CN 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-20240132492-A1 PYRIDOPYRIMIDINE-BASED COMPOUND AND APPLICATION THEREOF AKT3, AKT1S1, AKT2 GAA 1938/4885NPC1 4025/4885KMT2A 2151/4885

“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.