SCHEMBL1108916

SCHEMBL1108916

CCN(Cc1ccccc1)c1nnc(C2(c3ccccc3)CC2)n1C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.44
TSHR P16473 1/20 0.41
NR1I2 O75469 2/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
OPRM1 P35372 2/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
OPRL1 P41146 1/20 0.36
CNR2 P34972 1/20 0.35

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
SCHEMBL1108808 0.76 HSD11B1 (0.54) HSD11B1NR1I2OPRM1
SCHEMBL1108917 0.75 HSD11B1 (0.43) HSD11B1NR1I2OPRM1
SCHEMBL1108918 0.70 HSD11B1 (0.53) HSD11B1NR1I2
SCHEMBL1108919 0.70 HSD11B1 (0.39) HSD11B1NR1I2OPRM1OPRD1OPRK1
SCHEMBL1108785 0.66 HSD11B1 (0.54) HSD11B1TSHRNR1I2TP53
SCHEMBL1108789 0.66 HSD11B1 (0.77) HSD11B1NR1I2
SCHEMBL1108954 0.65 HSD11B1 (0.41) HSD11B1NR1I2
SCHEMBL1108859 0.65 ALDH1A1 (0.48) TSHRTP53MAPTOPRM1OPRD1
SCHEMBL1108915 0.64 HSD11B1 (0.43) HSD11B1NR1I2OPRM1OPRD1OPRK1
SCHEMBL1108839 0.64 HSD11B1 (0.53) HSD11B1NR1I2OPRM1OPRD1OPRK1

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 HSD11B1 1/4885TSHR 1976/4885NR1I2 211/4885
US-20080249084-A1 Triazole Compounds and Uses Related Thereto GPR119, CYP11B2, CYP11B1 HSD11B1 41/4885TSHR 778/4885NR1I2 606/4885

“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.