SCHEMBL29786262

SCHEMBL29786262

COc1nc(C2CCCCC2)cn1C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.37
LMNA P02545 1/20 0.34
PARP1 P09874 1/20 0.33
TACR3 P29371 1/20 0.33
KMO O15229 1/20 0.33
PDE4B Q07343 3/20 0.33
RPS6KB1 P23443 1/20 0.32
AKT1 P31749 1/20 0.32
GRM2 Q14416 1/20 0.32
ABL1 P00519 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
NPC1 O15118 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32

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
SCHEMBL29786301 0.93 PARP1 (0.35) PARP1PDE4BRAB9A
SCHEMBL24810569 0.81 SMN1; SMN2 (0.42) CNR2NPC1RAB9A
SCHEMBL24809790 0.80 MAPT (0.38) CNR2NPC1RAB9A
SCHEMBL27609704 0.79 RPS6KB1 (0.40) CNR2LMNAPARP1KMORPS6KB1
SCHEMBL24809746 0.76 ALDH1A1 (0.38) LMNARAB9A
SCHEMBL24810647 0.74 ALDH1A1 (0.38) LMNARAB9A
SCHEMBL24809766 0.73 BCHE (0.34) LMNAPDE4BNPC1RAB9A
SCHEMBL24810730 0.70 SMN1; SMN2 (0.37) CNR2NPC1RAB9A
SCHEMBL24811076 0.69 SMN1; SMN2 (0.45) NPC1RAB9A
SCHEMBL29786403 0.69 CNR2 (0.34) CNR2LMNAPDE4B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-29 US disclosed
CN-114787135-A Substituted imidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN 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-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, CLN6 CNR2 329/4885LMNA 882/4885PARP1 1049/4885

“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.