SCHEMBL2823926

SCHEMBL2823926

CC(C)(Oc1ccc(Cl)cc1)C(=NC#N)NC1C2CC3CC1CC(C(=O)NCc1ccc(S(N)(=O)=O)cc1)(C3)C2

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.79
HSD11B2 P80365 15/20 0.61
POLB P06746 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL2823923 1.00 HSD11B1 (0.79) HSD11B1HSD11B2POLBTDP1ALDH1A1
SCHEMBL2826010 0.90 HSD11B1 (0.68) HSD11B1HSD11B2
SCHEMBL2826009 0.90 HSD11B1 (0.68) HSD11B1HSD11B2
SCHEMBL2830625 0.89 HSD11B1 (0.78) HSD11B1HSD11B2
SCHEMBL2830623 0.89 HSD11B1 (0.78) HSD11B1HSD11B2
SCHEMBL1043160 0.89 HSD11B1 (1.00) HSD11B1HSD11B2POLBTDP1
SCHEMBL2830551 0.88 HSD11B1 (0.80) HSD11B1HSD11B2
SCHEMBL2830553 0.88 HSD11B1 (0.80) HSD11B1HSD11B2
SCHEMBL2828181 0.84 HSD11B1 (0.65) HSD11B1HSD11B2
SCHEMBL2828183 0.84 HSD11B1 (0.65) HSD11B1HSD11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507493-B2 Amide and amidine derivatives and uses thereof ABBVIE INC. (US) 2013-08-13 US claimed
EP-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP claimed
US-20100267738-A1 NOVEL AMIDE AND AMIDINE DERIVATIVES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-10-21 US claimed
US-8507493-B2 Amide and amidine derivatives and uses thereof ABBVIE INC. (US) 2013-08-13 US disclosed
EP-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP disclosed
US-20100267738-A1 NOVEL AMIDE AND AMIDINE DERIVATIVES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-10-21 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 (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-20100267738-A1 NOVEL AMIDE AND AMIDINE DERIVATIVES AND USES THEREOF HSD11B2, HSD11B1, HSD17B2 HSD11B1 2/4885HSD11B2 1/4885POLB 3614/4885

“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.