SCHEMBL510476

SCHEMBL510476

Cc1ccc(C(Cl)C(=O)O)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GRM1 Q13255 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP1A2 P05177 1/20 0.42
SRC P12931 1/20 0.40
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HTT P42858 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TRPA1 O75762 1/20 0.38
LMNA P02545 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
CACNA2D1 P54289 2/20 0.38
CACNA1B Q00975 2/20 0.38
CACNB1 Q02641 2/20 0.38
CACNA1G O43497 1/20 0.38

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
SCHEMBL28389560 0.85 LMNA (0.40) MEN1KMT2AGRM1TDP1CYP1A2
SCHEMBL6064118 0.85 TDP1 (0.39) MEN1KMT2AGRM1TDP1CYP1A2
SCHEMBL6841351 0.85 TDP1 (0.39) MEN1KMT2AGRM1TDP1CYP1A2
SCHEMBL6307444 0.83 MEN1 (0.41) MEN1KMT2ASRCTRPA1LMNA
SCHEMBL508992 0.83 TSHR (0.50) MEN1KMT2AGRM1TDP1CYP1A2
SCHEMBL1424025 0.80 ACHE (0.47) MEN1KMT2ATDP1SRCSMN1; SMN2
SCHEMBL509062 0.80 SRC (0.47) MEN1KMT2ATDP1SRCSMN1; SMN2
SCHEMBL6834772 0.80 SMN1; SMN2 (0.42) MEN1KMT2ACYP1A2SMN1; SMN2HTT
SCHEMBL7864024 0.80 MEN1 (0.44) MEN1KMT2AGRM1TDP1CYP1A2
SCHEMBL11836947 0.79 PPARG (0.46) MEN1KMT2AGRM1TDP1CYP1A2

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
WO-2016147132-A1 A PROCESS FOR THE PREPARATION OF DROXIDOPA Piramal Enterprises Limited (IN) 2016-09-22 WO disclosed
US-8507410-B2 Pyridazinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-13 US disclosed
US-8470738-B2 Pyridazinone compound and herbicide containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-06-25 US disclosed
US-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-02 US disclosed
EP-2188264-B1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME SUMITOMO CHEMICAL CO (JP) 2011-03-23 EP disclosed
US-20100216642-A1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-08-26 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 (2 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-20120028803-A1 PYRIDAZINONE COMPOUND AND USE THEREOF C5, C1S, WEE1 MEN1 806/4885KMT2A 4005/4885GRM1 1320/4885
US-20100216642-A1 PYRIDAZINONE COMPOUND AND HERBICIDE CONTAINING THE SAME WEE1, WEE2, CBR3 MEN1 2158/4885KMT2A 1764/4885GRM1 69/4885

“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.