SCHEMBL2823673

SCHEMBL2823673

CC(C)(Oc1ccc(Cl)cc1F)C(=NC1C2CC3CC(C2)CC1C3)NC#N

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.44
HSD11B2 P80365 3/20 0.44
USP30 Q70CQ3 1/20 0.35
CXCR3 P49682 6/20 0.34
P2RX7 Q99572 1/20 0.32
GPR6 P46095 1/20 0.32
AR P10275 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL2827937 0.89 HSD11B1 (0.47) HSD11B1HSD11B2USP30CXCR3P2RX7
SCHEMBL2827946 0.88 HSD11B1 (0.46) HSD11B1HSD11B2USP30
SCHEMBL2824621 0.86 HSD11B1 (0.43) HSD11B1HSD11B2USP30CXCR3P2RX7
SCHEMBL2823107 0.84 HSD11B1 (0.55) HSD11B1HSD11B2
SCHEMBL2834257 0.83 HSD11B1 (0.41) HSD11B1HSD11B2
SCHEMBL2823384 0.83 HSD11B1 (0.47) HSD11B1HSD11B2USP30P2RX7GPR6
SCHEMBL2822224 0.82 HSD11B1 (0.38) HSD11B1HSD11B2USP30P2RX7GPR6
SCHEMBL2823676 0.81 HSD11B1 (0.52) HSD11B1HSD11B2USP30CXCR3
SCHEMBL2823671 0.81 HSD11B1 (0.52) HSD11B1HSD11B2USP30CXCR3
SCHEMBL2827917 0.80 USP30 (0.38) HSD11B1HSD11B2USP30P2RX7GPR6

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
EP-2243479-A2 Novel amide and amidine derivates and uses thereof Abbott Laboratories (US) 2010-10-27 EP 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 1/4885USP30 2077/4885

“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.