SCHEMBL24809403

SCHEMBL24809403

O=C(NCCc1ccccc1)n1cnc(-c2ccccn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 1/20 0.50
KDM4E B2RXH2 3/20 0.48
KDM5B Q9UGL1 2/20 0.48
KDM5A P29375 1/20 0.48
KDM5C P41229 1/20 0.48
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HPGD P15428 1/20 0.45
GAA P10253 1/20 0.44
HPGDS O60760 2/20 0.43
P2RX4 Q99571 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALOX12 P18054 1/20 0.43
HSD17B10 Q99714 2/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL29817593 1.00 ASAH1 (0.50) ASAH1KDM4EKDM5BKDM5AKDM5C
SCHEMBL24809404 0.86 ALDH1A1 (0.47) ASAH1KDM4EKDM5BKDM5AKDM5C
SCHEMBL24810703 0.84 RAB9A (0.51) ASAH1KDM4EKDM5BKDM5AKDM5C
SCHEMBL24811030 0.82 CYP2C9 (0.54) ASAH1RAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL29817737 0.82 CYP2C9 (0.54) ASAH1RAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL29817397 0.81 KDM4E (0.44) KDM4ERAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL24809691 0.81 KDM4E (0.44) KDM4ERAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL24810551 0.80 KDM4E (0.38) KDM4EKDM5BKDM5AKDM5CRAB9A
SCHEMBL24809408 0.79 HIF1A (0.46) KDM4ERAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL24810560 0.79 HIF1A (0.46) KDM4EKDM5BKDM5AKDM5CRAB9A

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 ASAH1 16/4885KDM4E 701/4885KDM5B 526/4885

“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.