SCHEMBL21578985

SCHEMBL21578985

CSNc1ccc(C(O)CNC2CCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.57
▸ BCHE P06276 2/20 0.56
▸ ADRB2 P07550 3/20 0.43
▸ DHODH Q02127 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ EPHX1 P07099 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ SCN1A P35498 1/20 0.39

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
SCHEMBL21578944 0.99 KDM4E (0.55) KDM4EBCHEADRB2DHODHSMN1; SMN2
SCHEMBL21578943 0.96 KDM4E (0.51) KDM4EBCHEADRB2DHODHLMNA
SCHEMBL10879276 0.81 KDM4E (0.64) KDM4EBCHEADRB2SMN1; SMN2HTT
SCHEMBL21579057 0.80 BCHE (0.37) KDM4EBCHEADRB2SMN1; SMN2LMNA
SCHEMBL10876683 0.80 KDM4E (0.56) KDM4EBCHEADRB2DHODHLMNA
SCHEMBL10877567 0.77 KDM4E (0.88) KDM4EBCHELMNACYP1A2CYP2D6
SCHEMBL10877574 0.77 KDM4E (0.88) KDM4EBCHELMNACYP1A2CYP2D6
SCHEMBL19330018 0.77 KDM4E (0.63) KDM4EBCHEADRB2SMN1; SMN2NFKB1
Acetic Acid SCHEMBL19330042 0.73 KDM4E (0.66) KDM4EBCHEADRB2SMN1; SMN2LMNA
SCHEMBL9768074 0.72 ADRB2 (0.63) KDM4EBCHEADRB2NFKB1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11286235-B2 Ultra short acting anti-arrhythmic agents Academic Pharmaceuticals, Incorporated (US) 2022-03-29 — — US disclosed
US-20210107867-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS ACADEMIC PHARMACEUTICALS INCORPORATED 2021-04-15 — — US disclosed
US-10793519-B2 Ultra short acting anti-arrhythmic agents ACADEMIC PHARMACEUTICALS INCORPORATED (US) 2020-10-06 — — US disclosed
US-20190352257-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS ACADEMIC PHARMACEUTICALS INCORPORATED 2019-11-21 — — 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 (4 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-20190352257-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS SCN5A, CACNA1G, CACNA1H KDM4E 3169/4885BCHE 4218/4885ADRB2 53/4885
US-20210107867-A1 ULTRA SHORT ACTING ANTI-ARRHYTHMIC AGENTS SCN5A, CACNA1G, CACNA1H KDM4E 3169/4885BCHE 4218/4885ADRB2 53/4885
US-11286235-B2 Ultra short acting anti-arrhythmic agents SCN5A, CACNA1G, CACNA1H KDM4E 3169/4885BCHE 4218/4885ADRB2 53/4885
US-10793519-B2 Ultra short acting anti-arrhythmic agents SCN5A, CACNA1G, CACNA1H KDM4E 3169/4885BCHE 4218/4885ADRB2 53/4885

“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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