SCHEMBL24809691

SCHEMBL24809691

CC(C)CCNC(=O)n1cnc(-c2ccccn2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ALOX12 P18054 1/20 0.44
CNR1 P21554 1/20 0.44
KMT2A Q03164 1/20 0.41
NAMPT P43490 4/20 0.41
PSMB5 P28074 3/20 0.40
PSMB1 P20618 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 1/20 0.39
ANPEP P15144 1/20 0.38
RNPEP Q9H4A4 1/20 0.38
DNPEP Q9ULA0 1/20 0.38
HPGD P15428 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
SCHEMBL29817397 1.00 KDM4E (0.44) KDM4EALDH1A1ALOX12CNR1KMT2A
SCHEMBL24809435 0.85 FAAH (0.50) KDM4EKMT2ANAMPTPSMB5SMN1; SMN2
SCHEMBL24809403 0.81 ASAH1 (0.50) KDM4EALDH1A1ALOX12KMT2ASMN1; SMN2
SCHEMBL29817593 0.81 ASAH1 (0.50) KDM4EALDH1A1ALOX12KMT2ASMN1; SMN2
SCHEMBL24810808 0.81 LMNA (0.40) ALDH1A1CNR1KMT2ANAMPTPSMB5
SCHEMBL29817619 0.81 CYP2A6 (0.49) KDM4EALDH1A1PSMB5PSMB1SMN1; SMN2
SCHEMBL24810535 0.81 CYP2A6 (0.49) KDM4EALDH1A1PSMB5PSMB1SMN1; SMN2
SCHEMBL24810684 0.77 ADORA2A (0.38) HTT
SCHEMBL24810809 0.77 CNR1 (0.41) KDM4EALDH1A1CNR1KMT2ANAMPT
SCHEMBL29817631 0.77 CNR1 (0.41) KDM4EALDH1A1CNR1KMT2ANAMPT

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 KDM4E 701/4885ALDH1A1 1398/4885ALOX12 3291/4885

“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.