SCHEMBL4862238

SCHEMBL4862238

Clc1ccccc1-c1nnc2ccc(Oc3ccccc3)cn12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.44
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
RAB9A P51151 1/20 0.44
PDE2A O00408 3/20 0.40
PDE10A Q9Y233 3/20 0.40
APP P05067 1/20 0.37
BACE1 P56817 1/20 0.37
HPGD P15428 2/20 0.36
SLC2A1 P11166 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL4072097 0.77 HSD11B1 (0.49) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL15007237 0.77 HSD11B1 (0.52) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL5764736 0.75 HSD11B1 (0.44) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL4817084 0.75 MAOA (0.45) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL15006725 0.72 SLC6A2 (0.41) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL5767477 0.71 HSD11B1 (0.43) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL5766338 0.70 HSD11B1 (0.45) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL5763351 0.70 MAPK14 (0.56)
SCHEMBL4824406 0.70 MAPK14 (0.49)
SCHEMBL4825071 0.69 ALDH1A1 (0.48) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
US-7321040-B2 Triazolo-pyridines as anti-inflammatory compounds PFIZER INC. (US) 2008-01-22 US disclosed
EP-1601672-B1 TRIAZOLO-PYRIDINES AS ANTI-INFLAMMATORY COMPOUNDS PFIZER PROD INC (US) 2006-07-26 EP disclosed
US-20050075365-A1 Novel triazolo-pyridines as anti-inflammatory compounds PFIZER, INC. (US) 2005-04-07 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 (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-20050075365-A1 Novel triazolo-pyridines as anti-inflammatory compounds MAPK6, IL6, GRK6 HSD11B1 3008/4885ALDH1A1 3595/4885SMN1; SMN2 2194/4885

“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.