SCHEMBL6401188

SCHEMBL6401188

COc1ccc(C(C)=O)c(-c2ccc(OC)c(F)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.49
HPGD P15428 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 1/20 0.49
ORAI1 Q96D31 2/20 0.48
STIM1 Q13586 1/20 0.48
AR P10275 1/20 0.46
PTGS2 P35354 4/20 0.46
PTGS1 P23219 2/20 0.45
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 2/20 0.44
ABCB1 P08183 1/20 0.43
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CPS1 P31327 2/20 0.43
PRKCZ Q05513 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43

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
SCHEMBL9720067 0.83 PTGS2 (0.56) MAPK1ALDH1A1ARPTGS2PTGS1
SCHEMBL4602327 0.81 SMN1; SMN2 (0.68) MAPK1ALDH1A1ARPTGS2PTGS1
SCHEMBL2934843 0.78 ALDH1A1 (0.56) MAPK1HPGDALDH1A1CYP3A4LMNA
SCHEMBL14294261 0.77 RAB9A (0.48) MAPK1HPGDARPTGS2HTT
SCHEMBL5631648 0.77 MAPT (0.55) MAPK1HPGDALDH1A1CYP3A4LMNA
SCHEMBL22319299 0.76 ALDH1A1 (0.57) MAPK1HPGDALDH1A1CYP3A4AR
SCHEMBL29639738 0.75 ALDH1A1 (0.65) MAPK1HPGDALDH1A1CYP3A4LMNA
SCHEMBL531399 0.75 ALDH1A1 (0.65) MAPK1HPGDALDH1A1CYP3A4LMNA
SCHEMBL23397361 0.74 CYP1A1 (0.48) HPGDALDH1A1CYP3A4ARPTGS2
SCHEMBL12922047 0.74 ALDH1A1 (0.50) MAPK1HPGDALDH1A1CYP3A4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065155-A1 Novel pyridazine derivatives and medicines containing the same as effective ingredients KOWA CO., LTD. (JP) 2005-03-24 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-20050065155-A1 Novel pyridazine derivatives and medicines containing the same as effective ingredients IL1B, TLR1, IRAK1 MAPK1 145/4885HPGD 435/4885ALDH1A1 464/4885

“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.