SCHEMBL24477481

SCHEMBL24477481

Cc1ccn2ncc(C(=O)NCCc3ccc(-c4cnco4)cc3C)c2n1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.42
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
HPGD P15428 1/20 0.41
PDE2A O00408 1/20 0.40
HSD11B1 P28845 1/20 0.38
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
HKDC1 Q2TB90 1/20 0.38
JAK2 O60674 5/20 0.36
NTRK1 P04629 4/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
TGFBR1 P36897 2/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL24477291 0.92 TYK2 (0.42) TYK2ALDH1A1KDM4EHPGDPDE2A
SCHEMBL24477304 0.86 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDPDE2AHSD17B10
SCHEMBL24477483 0.80 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDHSD11B1HSD17B10
SCHEMBL24477303 0.78 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDPDE2ALMNA
SCHEMBL24477484 0.75 KDM4E (0.49) TYK2ALDH1A1KDM4EHPGDPDE2A
SCHEMBL24477307 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDLMNAHSD17B10
SCHEMBL20016113 0.74 PDE2A (0.55) TYK2ALDH1A1KDM4EHPGDPDE2A
SCHEMBL12943694 0.73 TYK2 (0.52) TYK2ALDH1A1KDM4EHPGDPDE2A
SCHEMBL24477486 0.72 GSK3A (0.48) ALDH1A1KDM4EHPGDHSD11B1LMNA
SCHEMBL19560173 0.72 TYK2 (0.51) TYK2ALDH1A1KDM4EHPGDPDE2A

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 TYK2 1719/4885ALDH1A1 1213/4885KDM4E 899/4885

“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.