SCHEMBL6490972

SCHEMBL6490972

CCOC(=O)N(C)c1ccc(CBr)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
TSHR P16473 2/20 0.43
CHRNB2 P17787 3/20 0.42
CHRNB4 P30926 3/20 0.42
CHRNA3 P32297 3/20 0.42
CHRNA4 P43681 3/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.36
CTDSP1 Q9GZU7 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
NR1H3 Q13133 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
AGPAT2 O15120 1/20 0.34
GRM5 P41594 1/20 0.34

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
SCHEMBL27556216 0.89 LMNA (0.44) LMNATSHRCHRNB2CHRNB4CHRNA3
SCHEMBL6492800 0.82 LMNA (0.50) LMNATSHRCHRNB2CHRNB4CHRNA3
SCHEMBL6492174 0.82 BRD4 (0.39) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL11002737 0.81 SMN1; SMN2 (0.35) LMNAALDH1A1SMN1; SMN2CYP3A4
SCHEMBL27556219 0.76 LMNA (0.40) LMNATSHRALDH1A1KMT2A
SCHEMBL9357885 0.76 CHRNB2 (0.61) LMNATSHRCHRNB2CHRNB4CHRNA3
SCHEMBL27576226 0.75 ALPL (0.38) LMNATSHRCHRNB2CHRNB4CHRNA3
SCHEMBL27576238 0.75 KMT2A (0.41) LMNATSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL11810258 0.74 LMNA (0.54) LMNATSHRALDH1A1KMT2AHPGD
SCHEMBL6300062 0.74 CA12 (0.53) LMNACYP4F2CYP4A11ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6890934-B2 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-05-10 US disclosed
US-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
US-20030171396-A1 Sulfonamide compounds and uses thereof as medicines FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-09-11 US disclosed
US-6573274-B1 Treatment of the diseases curable based on a hypoglycemic action, and the diseases curable based on a cGMP-PDE inhibitory action, a smooth muscle relaxing action, a bronchodilating action, a vasodilating action, a smooth muscle FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-06-03 US disclosed
EP-1136492-A1 SULFONAMIDE COMPOUNDS AND USES THEREOF AS MEDICINES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-26 EP 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-20030171396-A1 Sulfonamide compounds and uses thereof as medicines PDE2A, PDE3A, PDE5A LMNA 2742/4885TSHR 2673/4885CHRNB2 2045/4885
US-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD LMNA 3711/4885TSHR 2872/4885CHRNB2 4792/4885

“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.