SCHEMBL1108889

SCHEMBL1108889

Cn1c(N2CCC(Oc3ccc(Cl)c(C(=O)O)c3)CC2)nnc1C1(c2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 14/20 0.44
CCR3 P51677 14/20 0.44
KCNH2 Q12809 12/20 0.44
HSD11B1 P28845 3/20 0.41
FFAR4 Q5NUL3 3/20 0.39
NR1I2 O75469 1/20 0.36

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
SCHEMBL1108890 0.93 HSD11B1 (0.40) HRH1CCR3KCNH2HSD11B1FFAR4
SCHEMBL1108887 0.92 HSD11B1 (0.40) HRH1CCR3KCNH2HSD11B1FFAR4
SCHEMBL1108888 0.86 HSD11B1 (0.41) HRH1CCR3KCNH2HSD11B1FFAR4
SCHEMBL1108869 0.85 SRD5A1 (0.47) HRH1CCR3KCNH2HSD11B1NR1I2
SCHEMBL1108871 0.85 OPRK1 (0.43) HRH1CCR3KCNH2HSD11B1NR1I2
SCHEMBL1108860 0.84 HSD11B1 (0.57) HSD11B1NR1I2
SCHEMBL1108872 0.83 SCN1A (0.38) HSD11B1NR1I2
SCHEMBL1108880 0.81 OPRK1 (0.52) KCNH2
SCHEMBL1108870 0.81 HSD11B1 (0.41) HSD11B1
SCHEMBL1108873 0.81 EPHX2 (0.41) CCR3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153631-B2 Triazole compounds and uses related thereto AMGEN INC. (US) 2012-04-10 US disclosed
US-8153631-B2 Triazole compounds and uses related thereto AMGEN INC. (US) 2012-04-10 US disclosed
US-7683059-B2 Triazole compounds and uses related thereto AMGEN INC. (US) 2010-03-23 US disclosed
US-7683059-B2 Triazole compounds and uses related thereto AMGEN INC. (US) 2010-03-23 US disclosed
US-20100062972-A1 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC. 2010-03-11 US disclosed
US-20100062972-A1 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC. 2010-03-11 US disclosed
US-20080249084-A1 Triazole Compounds and Uses Related Thereto AMGEN SF LLC 2008-10-09 US disclosed
US-20080249084-A1 Triazole Compounds and Uses Related Thereto AMGEN SF LLC 2008-10-09 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-20100062972-A1 TRIAZOLE COMPOUNDS AND USES RELATED THERETO HSD11B1, HSD17B1, HSD17B3 HRH1 3796/4885CCR3 1882/4885KCNH2 4172/4885
US-20080249084-A1 Triazole Compounds and Uses Related Thereto GPR119, CYP11B2, CYP11B1 HRH1 3627/4885CCR3 2071/4885KCNH2 3336/4885

“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.