SCHEMBL22601463

SCHEMBL22601463

CC(C)(C)c1cc(S(=O)(=O)N2CCCCC2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.56
▸ GAA P10253 1/20 0.56
▸ USP2 O75604 1/20 0.51
▸ ALDH1A1 P00352 6/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ TSHR P16473 4/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ THRB P10828 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MCOLN3 Q8TDD5 2/20 0.48
▸ HTT P42858 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL22601462 0.85 KDM4E (0.60) LMNAGAAALDH1A1SMN1; SMN2TSHR
SCHEMBL24296648 0.80 ALDH1A1 (0.55) LMNAGAAUSP2ALDH1A1SMN1; SMN2
SCHEMBL17808302 0.75 SMN1; SMN2 (0.56) LMNAGAAALDH1A1SMN1; SMN2TSHR
SCHEMBL270805 0.74 LMNA (0.67) LMNAGAAUSP2ALDH1A1SMN1; SMN2
SCHEMBL24453154 0.73 PRKCI (0.41) LMNAALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL4555408 0.72 LMNA (1.00) LMNAGAAUSP2ALDH1A1POLB
SCHEMBL9906448 0.72 LMNA (1.00) LMNAGAAUSP2ALDH1A1POLB
SCHEMBL12293097 0.72 LMNA (0.64) LMNAGAAUSP2ALDH1A1SMN1; SMN2
SCHEMBL22601565 0.72 CA1 (0.48) LMNASMN1; SMN2HTTHSD17B10
SCHEMBL22601451 0.71 HRH4 (0.54) LMNAGAAALDH1A1SMN1; SMN2TSHR

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-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 HEPAGENE THERAPEUTICS, INC. (VG) 2020-10-29 — — US disclosed
US-20160303110-A1 METHODS OF TREATING ABNORMAL MUSCULAR ACTIVITY AUSPEX PHARMACEUTICALS, INC. (US) 2016-10-20 — — 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 (2 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-20160303110-A1 METHODS OF TREATING ABNORMAL MUSCULAR ACTIVITY PYGM, TNNC1, MUSK LMNA 645/4885GAA 40/4885USP2 1421/4885
US-20200339530-A1 UREA DERIVATIVES AS INHIBITORS OF ASK1 ATF1, ERN1, MAP3K1 LMNA 3233/4885GAA 3024/4885USP2 131/4885

“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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