SCHEMBL24700304

SCHEMBL24700304

CC1(C)CC(=O)C(Cc2ccccc2)CN1C(=O)NCCCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 12/20 0.48
▸ NAMPT P43490 2/20 0.48
▸ HPGD P15428 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ EPHX2 P34913 2/20 0.43
▸ FKBP1A P62942 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
SCHEMBL23124129 0.91 ASAH1 (0.41) ASAH1NAMPTHPGDSMN1; SMN2EPHX2
SCHEMBL23123717 0.87 ASAH1 (0.50) ASAH1NAMPTHPGDSMN1; SMN2
SCHEMBL28838828 0.86 ASAH1 (0.38) ASAH1NAMPTEPHX2
SCHEMBL23123524 0.85 EPHX2 (0.48) ASAH1NAMPTHPGDSMN1; SMN2EPHX2
Hydrochloric Acid SCHEMBL23123825 0.78 ASAH1 (0.42) ASAH1NAMPT
SCHEMBL23123805 0.77 ASAH1 (0.52) ASAH1NAMPTHPGDEPHX2
Hydrochloric Acid SCHEMBL23123899 0.77 EPHX2 (0.41) ASAH1NAMPTHPGDSMN1; SMN2EPHX2
SCHEMBL24700156 0.74 KLK7 (0.43) —
SCHEMBL23123829 0.74 EPHX2 (0.51) ASAH1NAMPTHPGDSMN1; SMN2EPHX2
SCHEMBL23124166 0.73 NAMPT (0.50) ASAH1NAMPTHPGDSMN1; SMN2EPHX2

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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-01 — — US disclosed
CN-114901652-A Substituted saturated and unsaturated N-heterocyclic carboxamides and related compounds for the treatment of medical disorders 比亚尔R&D投资股份公司 2022-08-12 — — 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-20220380314-A1 SUBSTITUTED, SATURATED AND UNSATURATED N-HETEROCYCLIC CARBOXAMIDES AND RELATED COMPOUNDS FOR THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GBA2, CLN6 ASAH1 8/4885NAMPT 92/4885HPGD 213/4885

“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.

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