SCHEMBL24848142

SCHEMBL24848142

COC(=O)C1CCCN(CC(=O)OCc2ccccc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 8/20 0.46
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CASP3 P42574 1/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CPB1 P15086 1/20 0.42
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
ACE P12821 1/20 0.41

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
SCHEMBL15368459 0.83 PER2 (0.45) FKBP1ANPC1RAB9ASMN1; SMN2CASP3
Hydrochloric Acid SCHEMBL5555279 0.82 FKBP1A (0.54) FKBP1ASMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL22981228 0.81 NPC1 (0.49) FKBP1AHTTNPC1RAB9ASMN1; SMN2
SCHEMBL5551252 0.81 ALDH1A1 (0.43) FKBP1ANPC1RAB9ASMN1; SMN2CASP3
SCHEMBL8082401 0.81 SMN1; SMN2 (0.44) FKBP1ANPC1RAB9ASMN1; SMN2CASP3
Hydrochloric Acid SCHEMBL8082397 0.80 SMN1; SMN2 (0.43) FKBP1ANPC1RAB9ASMN1; SMN2CASP3
Hydrochloric Acid SCHEMBL8082404 0.80 SMN1; SMN2 (0.43) FKBP1ANPC1RAB9ASMN1; SMN2CASP3
SCHEMBL2070172 0.80 FKBP1A (0.54) FKBP1ASMN1; SMN2ALDH1A1NPSR1MAPT
SCHEMBL14603128 0.78 CASP3 (0.61) CASP3ALDH1A1CPB1ACE
SCHEMBL14603132 0.78 CASP3 (0.61) CASP3ALDH1A1CPB1ACE

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-20230002388-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH CO., LTD. (CN) 2023-01-05 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-20230002388-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NSD2, NSD1, NSD3 FKBP1A 3573/4885HTT 3569/4885NPC1 763/4885

“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.