SCHEMBL23901523

SCHEMBL23901523

Cc1cc(-c2cccnc2)nc2c(C(=O)Nc3ccc(-c4ccco4)cn3)ncn12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.42
ABCC1 P33527 2/20 0.42
WNT3A P56704 1/20 0.40
MCL1 Q07820 7/20 0.39
DEGS1 O15121 1/20 0.39
ATR Q13535 3/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
IDE P14735 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2D6 P10635 1/20 0.37
PORCN Q9H237 1/20 0.37

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
SCHEMBL23901594 0.85 ALDH1A1 (0.42) MCL1TP53RAB9ASMN1; SMN2
SCHEMBL22472778 0.83 TSHR (0.39) NPC1TP53ALOX15RAB9ASMN1; SMN2
SCHEMBL19449609 0.77 DYRK1A (0.47) ATRKMT2A
SCHEMBL19438303 0.75 KDM4E (0.46) ATR
SCHEMBL17741238 0.74 TP53 (0.44) ATRNPC1TP53RAB9ASMN1; SMN2
SCHEMBL19681732 0.74 MKNK1 (0.44) ATRKMT2A
SCHEMBL19681745 0.73 ADORA2A (0.39) ATRNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL22472788 0.73 MAPT (0.46) ATRNPC1TP53RAB9AKMT2A
SCHEMBL23901593 0.73 PTGIR (0.42) NPC1TP53RAB9ASMN1; SMN2KMT2A
SCHEMBL23901571 0.72 LMNA (0.46) ATRRAB9ASMN1; SMN2KMT2A

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-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2021-10-07 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-20210309661-A1 IMIDAZO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, GBA2 ABCB1 1923/4885ABCC1 3838/4885WNT3A 4508/4885

“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.