SCHEMBL3621998

SCHEMBL3621998

Fc1ccccc1-c1nnc2cc(I)ccn12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PTAFR P25105 1/20 0.38
MAPK13 O15264 1/20 0.36
PDE2A O00408 4/20 0.36
PDE10A Q9Y233 4/20 0.36
POLB P06746 1/20 0.36
DCTPP1 Q9H773 1/20 0.36
NOTUM Q6P988 1/20 0.35
KCNN4 O15554 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPK14 Q16539 1/20 0.34
CHRM1 P11229 1/20 0.33

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
SCHEMBL3622123 0.83 MAPK14 (0.43) KDM4EPDE2APDE10AMAPK14
SCHEMBL10288930 0.83 DNMT1 (0.49) HSD11B1KDM4EMAPK13PDE2APDE10A
SCHEMBL379692 0.82 HSD11B1 (0.52) HSD11B1KDM4EMAPK13PDE2APDE10A
SCHEMBL3623290 0.82 HSD11B1 (0.47) HSD11B1KDM4EPTAFRMAPK13PDE2A
SCHEMBL380073 0.82 HSD11B1 (0.40) HSD11B1KDM4EMAPK13PDE2APDE10A
SCHEMBL3620228 0.78 ABL1 (0.51) HSD11B1KDM4EMAPK14
SCHEMBL2023855 0.74 PDE2A (0.47) HSD11B1KDM4EPDE2APDE10APOLB
SCHEMBL3620581 0.71 LMNA (0.47) HSD11B1KDM4EMAPK13PDE2APDE10A
SCHEMBL3622223 0.70 DNMT1 (0.33)
SCHEMBL3619423 0.69 TNKS (0.38) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8258122-B2 3-([1,2,4]triazolo[4,3-a]pyridin-7-yl)benzamide derivatives ALMIRALL, S.A. (ES) 2012-09-04 US disclosed
US-8258122-B2 3-([1,2,4]triazolo[4,3-a]pyridin-7-yl)benzamide derivatives ALMIRALL, S.A. (ES) 2012-09-04 US disclosed
US-8258122-B2 3-([1,2,4]triazolo[4,3-a]pyridin-7-yl)benzamide derivatives ALMIRALL, S.A. (ES) 2012-09-04 US disclosed
US-20100120731-A1 3-([1,2,4]TRIAZOLO [4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES ALMIRALL, S.A. (ES) 2010-05-13 US disclosed
US-20100120731-A1 3-([1,2,4]TRIAZOLO [4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES ALMIRALL, S.A. (ES) 2010-05-13 US disclosed
US-20100120731-A1 3-([1,2,4]TRIAZOLO [4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES ALMIRALL, S.A. (ES) 2010-05-13 US disclosed
EP-2118100-A1 NEW 3- ([1,2,4] TRIAZOLO [4,3-A] PYRIDIN-7-YL)BENZAMIDE DERIVATIVES Almirall, S.A. (ES) 2009-11-18 EP disclosed
WO-2008107125-A1 NEW 3-([1,2,4]TRIAZOLO[4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES ALMIRALL, S.A. (ES) 2008-09-12 WO disclosed
WO-2008107125-A1 NEW 3-([1,2,4]TRIAZOLO[4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES ALMIRALL, S.A. (ES) 2008-09-12 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 (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-20100120731-A1 3-([1,2,4]TRIAZOLO [4,3-A]PYRIDIN-7-YL)BENZAMIDE DERIVATIVES MAP4K2, MAP3K7, MAPK7 HSD11B1 4180/4885KDM4E 3309/4885PTAFR 669/4885

“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.