SCHEMBL1099745

SCHEMBL1099745

Cn1c(-c2ccc(C(=O)NCCN3CCOCC3)cc2Cl)nnc1C1(c2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.54
NR1I2 O75469 2/20 0.54
HSD11B1 P28845 2/20 0.54
TNKS2 Q9H2K2 1/20 0.53
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
CD274 Q9NZQ7 2/20 0.48
HPGD P15428 1/20 0.48
ALDH1A1 P00352 2/20 0.48
HTR1A P08908 1/20 0.48
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
KCNH2 Q12809 1/20 0.48
HTT P42858 1/20 0.47
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL1101579 0.87 HSD11B1 (0.59) NR1I2HSD11B1POLBHPGDHTT
SCHEMBL1108774 0.86 HSD11B1 (0.58) NR1I2HSD11B1
Hydrochloric Acid SCHEMBL1100081 0.85 HSD11B1 (0.58) NR1I2HSD11B1
SCHEMBL1108773 0.85 HSD11B1 (0.58) NR1I2HSD11B1TNKS2HPGDHTT
Hydrochloric Acid SCHEMBL1101367 0.85 HSD11B1 (0.57) NR1I2HSD11B1TNKS2HPGDHTT
SCHEMBL1100573 0.85 HSD11B1 (0.57) NR1I2HSD11B1POLBKMT2A
SCHEMBL1108766 0.84 HSD11B1 (0.61) NR1I2HSD11B1HPGD
Hydrochloric Acid SCHEMBL1101368 0.83 HSD11B1 (0.60) NR1I2HSD11B1HPGD
SCHEMBL1101527 0.83 HSD11B1 (0.58) NR1I2HSD11B1
SCHEMBL1108770 0.82 HSD11B1 (0.64) NR1I2HSD11B1

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 14 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
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

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 PDE2A 789/4885NR1I2 211/4885HSD11B1 1/4885
US-20080249084-A1 Triazole Compounds and Uses Related Thereto GPR119, CYP11B2, CYP11B1 PDE2A 811/4885NR1I2 606/4885HSD11B1 41/4885

“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.