SCHEMBL497767

SCHEMBL497767

[CH2]CCCc1cc(-c2ccoc2)co1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA4 P43681 2/20 0.33
ALDH1A1 P00352 2/20 0.32
CYP2C19 P33261 2/20 0.32
CLK4 Q9HAZ1 2/20 0.32
MEN1 O00255 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ERN1 O75460 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5541566 0.79 CTRC (0.36) ALDH1A1USP2
SCHEMBL5545899 0.77 ALDH1A1 (0.32) ALDH1A1MEN1ALOX15KMT2AHSD17B10
SCHEMBL5539424 0.77 MAOB (0.33) ALDH1A1CYP2C19HSD17B10CYP1A2
SCHEMBL498209 0.77 TAAR1 (0.39) ALDH1A1MEN1ALOX15KMT2AHSD17B10
SCHEMBL5535282 0.75 CTRC (0.35) ALDH1A1ALOX15USP2CYP3A4
SCHEMBL5543970 0.73 ALDH1A1 (0.36) ALDH1A1ALOX15USP2CYP3A4
SCHEMBL5542932 0.73 MAOB (0.40) ALDH1A1CLK4TSHR
SCHEMBL5540626 0.72 SIRT2 (0.32) ALDH1A1HSD17B10TSHR
SCHEMBL5545718 0.72 MAOB (0.33) ALDH1A1CYP2C19ALOX15HSD17B10CYP1A2
SCHEMBL5547178 0.71 HDAC1 (0.33) ALDH1A1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157084-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA CO (JP) 2013-05-22 EP disclosed
US-8106053-B2 5-phenyl-3-pyridazinone derivative KOWA COMPANY, LTD. 2012-01-31 US disclosed
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA COMPANY, LTD. (JP) 2010-08-05 US disclosed
EP-2157084-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-02-24 EP 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-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE SERPINE1, MMP1, PLAT CHRNA4 4143/4885ALDH1A1 818/4885CYP2C19 1406/4885

“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.