SCHEMBL23573282

SCHEMBL23573282

CC(C)(O)Cn1ncc(N2C[CH]CC2)c(Cl)c1=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.47
GAA P10253 2/20 0.47
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 2/20 0.38
MITF O75030 1/20 0.38
HTT P42858 1/20 0.38
DCTPP1 Q9H773 1/20 0.37
MAPT P10636 1/20 0.34

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
SCHEMBL23573405 0.81 RAB9A (0.47) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573498 0.79 RAB9A (0.54) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573415 0.79 RAB9A (0.45) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573420 0.79 RAB9A (0.44) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573513 0.78 GAA (0.44) RAB9AGAALMNAPOLBPKM
SCHEMBL23573225 0.78 RAB9A (0.42) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573372 0.77 RAB9A (0.52) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573401 0.77 RAB9A (0.44) RAB9AGAANPC1SMN1; SMN2MEN1
SCHEMBL23573211 0.76 ALDH1A1 (0.50) RAB9AGAANPC1PKMALDH1A1
SCHEMBL23462539 0.66 POLB (0.67) POLBALDH1A1

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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-07-01 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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR ENTPD5, ADORA2A, ENTPD1 RAB9A 2930/4885GAA 546/4885NPC1 1512/4885

“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.