SCHEMBL19475583

SCHEMBL19475583

CCc1cc(F)cc(CC)c1CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 2/20 0.41
TSHR P16473 1/20 0.38
HSD17B10 Q99714 3/20 0.37
MAPT P10636 5/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
AKR1B1 P15121 1/20 0.36
PTGDR2 Q9Y5Y4 3/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PTGDR Q13258 1/20 0.35
MEN1 O00255 2/20 0.34
POLB P06746 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34

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
SCHEMBL20681219 0.86 MAPT (0.44) AGBL2TSHRHSD17B10MAPTKDM4E
SCHEMBL510120 0.81 MAPT (0.46) TSHRMAPTKDM4EALOX15AKR1B1
SCHEMBL509065 0.81 RXRA (0.40) TSHRHSD17B10MAPTKDM4ELMNA
SCHEMBL24783717 0.80 KDM4E (0.32) HSD17B10MAPTKDM4ELMNATP53
SCHEMBL509958 0.79 PTGDR2 (0.46) HSD17B10KDM4EAKR1B1PTGDR2ALDH1A1
Hydrochloric Acid SCHEMBL20740117 0.79 MAPT (0.45) TSHRMAPTKDM4EALOX15AKR1B1
SCHEMBL509872 0.79 THRB (0.41) HSD17B10MAPTKDM4EAKR1B1PTGDR2
SCHEMBL509209 0.79 RXRA (0.49) AGBL2LMNAPTGDR2RXRARXRB
SCHEMBL22067766 0.77 MAPT (0.41) AGBL2TSHRMAPTKDM4EALOX15
SCHEMBL20699034 0.77 AGBL2 (0.44) AGBL2HSD17B10MAPTKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3445749-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-12-21 EP disclosed
EP-3445749-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-12-21 EP disclosed
US-20220387397-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2022-12-08 US disclosed
US-11447460-B2 Compounds and compositions for treating conditions associated with NLRP activity NOVARTIS AG (CH) 2022-09-20 US disclosed
CN-113347970-A Compounds and compositions for treating conditions associated with NLRP activity 诺华股份有限公司 2021-09-03 CN disclosed
US-20190119241-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2019-04-25 US disclosed
US-20190119241-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2019-04-25 US disclosed
WO-2017184604-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY IFM THERAPEUTICS, INC (US) 2017-10-26 WO disclosed
WO-2017184604-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY IFM THERAPEUTICS, INC (US) 2017-10-26 WO 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-20220387397-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 AGBL2 687/4885TSHR 4044/4885HSD17B10 1203/4885
US-20190119241-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 AGBL2 917/4885TSHR 4318/4885HSD17B10 1254/4885
US-11447460-B2 Compounds and compositions for treating conditions associated with NLRP activity NLRP1, NLRP3, NOD1 AGBL2 664/4885TSHR 4103/4885HSD17B10 1225/4885

“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.