SCHEMBL24477482

SCHEMBL24477482

Cc1ccnc2c(C(=O)NCc3ccc(-c4ccco4)cc3)cnn12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.54
PRKCZ Q05513 1/20 0.54
MARK2 Q7KZI7 1/20 0.54
ADORA3 P0DMS8 10/20 0.53
ADORA2A P29274 9/20 0.53
ADORA1 P30542 9/20 0.52
KDM4E B2RXH2 6/20 0.51
ALDH1A1 P00352 5/20 0.51
HPGD P15428 4/20 0.51
CYP1A1 P04798 1/20 0.49
HSD17B10 Q99714 1/20 0.48
MAPT P10636 2/20 0.48
CDK1 P06493 1/20 0.47
PIM1 P11309 1/20 0.47
MAPKAPK2 P49137 1/20 0.47
GSK3A P49840 1/20 0.47
PLK1 P53350 1/20 0.47
AURKB Q96GD4 1/20 0.47
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL24477485 0.90 ALDH1A1 (0.52) PDPK1PRKCZMARK2ADORA3ADORA2A
SCHEMBL24477299 0.86 ALDH1A1 (0.71) ADORA3ADORA2AADORA1KDM4EALDH1A1
SCHEMBL24477290 0.79 ADORA3 (0.50) ADORA3ADORA2AADORA1KDM4EALDH1A1
SCHEMBL22472767 0.79 ADORA2A (0.43) ADORA3ADORA2AADORA1ALDH1A1MAPT
SCHEMBL24477300 0.77 ALDH1A1 (0.72) ADORA3ADORA2AADORA1KDM4EALDH1A1
SCHEMBL24477486 0.74 GSK3A (0.48) PDPK1PRKCZMARK2KDM4EALDH1A1
SCHEMBL22767520 0.72 HSD11B1 (0.44) PDPK1PRKCZMARK2KDM4EALDH1A1
SCHEMBL17739834 0.71 GBA1 (0.63) KDM4EALDH1A1HPGDCYP1A1HSD17B10
SCHEMBL24477293 0.71 APOBEC3A (0.50) ADORA3ADORA2AADORA1KDM4EALDH1A1
SCHEMBL22472753 0.71 APOBEC3A (0.46) ADORA3ADORA2AADORA1KDM4EALDH1A1

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-20220169652-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS LYSOSOMAL THERAPEUTICS INC. 2022-06-02 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-20220169652-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS PARK7, PNP, GAA PDPK1 160/4885PRKCZ 2235/4885MARK2 2807/4885

“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.