SCHEMBL1099405

SCHEMBL1099405

CONC(=O)Nc1cccc(-c2nnc(C3(c4ccc(F)cc4)CC3)n2C(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.52
MEN1 O00255 1/20 0.40
CASP6 P55212 1/20 0.40
KMT2A Q03164 1/20 0.40
MAP3K5 Q99683 2/20 0.39
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CCR3 P51677 9/20 0.38
CYP2D6 P10635 7/20 0.38
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
GRIN2B Q13224 1/20 0.36
CNR1 P21554 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
SCHEMBL1100922 0.89 HSD11B1 (0.60) HSD11B1MEN1KMT2ASMN1; SMN2OPRM1
SCHEMBL1100810 0.81 HSD11B1 (0.55) HSD11B1MAP3K5OPRM1OPRD1OPRK1
SCHEMBL1108945 0.80 HSD11B1 (0.63) HSD11B1
SCHEMBL1108955 0.77 HSD11B1 (0.60) HSD11B1
SCHEMBL1108820 0.77 HSD11B1 (0.62) HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1108944 0.75 HSD11B1 (0.78) HSD11B1
SCHEMBL1101035 0.74 HSD11B1 (0.57) HSD11B1
SCHEMBL1101068 0.74 HSD11B1 (0.64) HSD11B1
SCHEMBL1108947 0.72 HSD11B1 (0.67) HSD11B1MEN1KMT2AALDH1A1
SCHEMBL1108950 0.72 HSD11B1 (0.64) HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683059-B2 Triazole compounds and uses related thereto AMGEN INC. (US) 2010-03-23 US claimed
US-20080249084-A1 Triazole Compounds and Uses Related Thereto AMGEN SF LLC 2008-10-09 US claimed
EP-1680114-A4 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC (US) 2008-09-24 EP claimed
EP-1680114-A2 TRIAZOLE COMPOUNDS AND USES RELATED THERETO Amgen Inc. (US) 2006-07-19 EP claimed
WO-2005044192-A2 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC. (US) 2005-05-19 WO claimed
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-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-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-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
US-20080249084-A1 Triazole Compounds and Uses Related Thereto AMGEN SF LLC 2008-10-09 US disclosed
EP-1680114-A4 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC (US) 2008-09-24 EP disclosed
EP-1680114-A2 TRIAZOLE COMPOUNDS AND USES RELATED THERETO Amgen Inc. (US) 2006-07-19 EP disclosed
WO-2005044192-A2 TRIAZOLE COMPOUNDS AND USES RELATED THERETO AMGEN INC. (US) 2005-05-19 WO 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 HSD11B1 1/4885MEN1 2815/4885CASP6 1725/4885
US-20080249084-A1 Triazole Compounds and Uses Related Thereto GPR119, CYP11B2, CYP11B1 HSD11B1 41/4885MEN1 2451/4885CASP6 1474/4885

“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.