SCHEMBL26633874

SCHEMBL26633874

COc1ccc(CNC(=O)NCCCCC2CCNCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ CASR P41180 1/20 0.49
▸ ITGB3 P05106 4/20 0.47
▸ ITGA2B P08514 4/20 0.47
▸ NAMPT P43490 1/20 0.47
▸ KMT2A Q03164 1/20 0.44
▸ ROCK2 O75116 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL24011651 0.85 MEN1 (0.54) SMN1; SMN2ALDH1A1NPC1RAB9AITGB3
SCHEMBL26633714 0.83 NAMPT (0.48) SMN1; SMN2ALDH1A1ITGB3ITGA2BNAMPT
SCHEMBL26633836 0.82 NAMPT (0.50) ALDH1A1NAMPT
SCHEMBL26633796 0.79 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1NPC1RAB9ACASR
SCHEMBL24011184 0.79 NAMPT (0.57) CASRNAMPT
SCHEMBL24011366 0.78 SMN1; SMN2 (0.76) SMN1; SMN2ALDH1A1NPC1RAB9APOLB
SCHEMBL26633900 0.78 NAMPT (0.46) NAMPT
SCHEMBL24011100 0.77 CYP2C9 (0.49) SMN1; SMN2NPC1CASRNAMPT
SCHEMBL29207994 0.77 ALDH1A1 (0.62) SMN1; SMN2ALDH1A1NPC1RAB9AKMT2A
SCHEMBL24011409 0.76 CASR (0.59) SMN1; SMN2ALDH1A1NPC1RAB9ACASR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 — — US disclosed
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 — — US disclosed
US-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 — — 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-20230348369-A1 NAMPT MODULATORS NAMPT, NNT, NAPRT SMN1; SMN2 610/4885ALDH1A1 982/4885NPC1 128/4885

“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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