SCHEMBL22472786

SCHEMBL22472786

Cc1ccnc2c(C(=O)NCc3ccc(-c4ccco4)cn3)ncn12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ADORA2A P29274 4/20 0.38
ADORA1 P30542 3/20 0.38
ADORA3 P0DMS8 3/20 0.38
KDM4E B2RXH2 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ADORA2B P29275 2/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
THRB P10828 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
NR4A1 P22736 1/20 0.38
APEX1 P27695 1/20 0.38

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
SCHEMBL22472758 0.91 MAPT (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472754 0.88 KDM4E (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472767 0.87 ADORA2A (0.43) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472802 0.86 NPC1 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472774 0.82 ALDH1A1 (0.42) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472790 0.81 KDM4E (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472769 0.79 ALDH1A1 (0.38) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL25584699 0.78 CA12 (0.34) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL22472807 0.77 KDM4E (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2ADORA2A
SCHEMBL23901594 0.76 ALDH1A1 (0.42) ALDH1A1RAB9ASMN1; SMN2ADORA2AADORA1

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-10786508-B2 Substituted imidazo[1,5-A]-pyrimidines and their use in the treatment of medical disorders LYSOSOMAL THERAPEUTICS INC. (US) 2020-09-29 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-10786508-B2 Substituted imidazo[1,5-A]-pyrimidines and their use in the treatment of medical disorders GBA1, GAA, SNCA ALDH1A1 1025/4885NPC1 823/4885RAB9A 1395/4885

“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.