SCHEMBL6370909

SCHEMBL6370909

O=c1c(Br)c(OCc2ccccc2)cnn1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 1.00
RAB9A P51151 7/20 0.57
SMN1; SMN2 Q16637 7/20 0.57
ALDH1A1 P00352 6/20 0.57
LMNA P02545 5/20 0.57
NPC1 O15118 4/20 0.57
HTT P42858 2/20 0.57
MAPT P10636 1/20 0.57
PAX8 Q06710 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
POLB P06746 2/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.50
MCL1 Q07820 1/20 0.48

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
SCHEMBL9666271 0.84 MAPK14 (0.72) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL6288420 0.83 MAPK14 (1.00) MAPK14ALDH1A1LMNAPOLBKMT2A
SCHEMBL6232624 0.81 MAPK14 (0.67) MAPK14ALDH1A1HTT
SCHEMBL31362164 0.75 MAPK14 (0.60) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL6265589 0.75 MAPK14 (0.62) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL17979313 0.75 ALDH1A1 (0.62) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL4743412 0.74 RAB9A (1.00) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL28631591 0.73 MAPK14 (0.57) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL6234554 0.73 MAPK14 (1.00) MAPK14ALDH1A1L3MBTL1
SCHEMBL13219474 0.72 ALDH1A1 (0.70) MAPK14RAB9ASMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256122-A1 Substituted pyridazinones PHARMACIA CORPORATION 2005-11-17 US claimed
US-20050020594-A1 Substituted pyridazinones PHARMACIA CORPORATION 2005-01-27 US claimed
US-20040142932-A1 Substituted pyridazinones PHARMACIA CORPORATION 2004-07-22 US claimed
US-20050256122-A1 Substituted pyridazinones PHARMACIA CORPORATION 2005-11-17 US disclosed
US-20050020594-A1 Substituted pyridazinones PHARMACIA CORPORATION 2005-01-27 US disclosed
US-20040142932-A1 Substituted pyridazinones PHARMACIA CORPORATION 2004-07-22 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 (3 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-20040142932-A1 Substituted pyridazinones MAP4K2, MAPK6, MAP3K6 MAPK14 29/4885RAB9A 2668/4885SMN1; SMN2 1185/4885
US-20050020594-A1 Substituted pyridazinones MAP4K2, MAPK6, MAP3K6 MAPK14 34/4885RAB9A 2627/4885SMN1; SMN2 1153/4885
US-20050256122-A1 Substituted pyridazinones MAP4K2, MAPK6, MAP3K6 MAPK14 34/4885RAB9A 2627/4885SMN1; SMN2 1153/4885

“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.