SCHEMBL22978720

SCHEMBL22978720

COC(=O)C1CCCN(C(=O)O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
HIF1A Q16665 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 2/20 0.33
BRD4 O60885 1/20 0.33
TP53 P04637 1/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
SLC6A3 Q01959 2/20 0.33
FKBP1A P62942 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL20955875 0.81 ALDH1A1 (0.56) CYP1A2HIF1ASMN1; SMN2ALDH1A1MAPT
SCHEMBL2479515 0.80 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1HSD17B10
SCHEMBL26663249 0.80 PDE4B (0.45) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL13043822 0.79 CYP1A2 (0.44) CYP1A2HIF1ASMN1; SMN2POLBBRD4
SCHEMBL17459681 0.76 PDE4B (0.47) ALDH1A1MAPTHPGDFKBP1A
SCHEMBL22981228 0.76 NPC1 (0.49) SMN1; SMN2ALDH1A1NPSR1TP53FKBP1A
SCHEMBL542160 0.75 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1HPGDPOLB
SCHEMBL25318734 0.73 PIK3CD (0.35) SMN1; SMN2ALDH1A1HPGDCHRM2CHRM4
SCHEMBL23227312 0.72 SMN1; SMN2 (0.41) CYP1A2HIF1ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL20351103 0.72 SMN1; SMN2 (0.41) CYP1A2HIF1ASMN1; SMN2ALDH1A1NPSR1

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
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
US-11420970-B1 Piperidinyl-methyl-purineamines as NSD2 inhibitors and anti-cancer agents NOVARTIS AG (CH) 2022-08-23 US disclosed
EP-4013755-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS Novartis AG (CH) 2022-06-22 EP disclosed
WO-2021026803-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NOVARTIS AG (CH) 2021-02-18 WO disclosed
WO-2021028854-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NOVARTIS AG (CH) 2021-02-18 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-11420970-B1 Piperidinyl-methyl-purineamines as NSD2 inhibitors and anti-cancer agents NSD2, NSD1, NSD3 CYP1A2 4146/4885HIF1A 3038/4885SMN1; SMN2 860/4885
US-20230002388-A1 PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS NSD2, NSD1, NSD3 CYP1A2 4146/4885HIF1A 3038/4885SMN1; SMN2 860/4885

“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.