SCHEMBL20563201

SCHEMBL20563201

CCOc1cc2ccccc2c(F)c1O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.46
TLR8 Q9NR97 1/20 0.43
L3MBTL1 Q9Y468 4/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GUSB P08236 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ADORA1 P30542 2/20 0.37
ADORA2A P29274 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL28875355 0.85 ALOX5 (0.49) ALOX5TLR8L3MBTL1TP53MAPT
SCHEMBL20563187 0.82 ALOX5 (0.47) ALOX5TLR8L3MBTL1TP53MAPT
SCHEMBL20562381 0.81 NQO1 (0.46) L3MBTL1MAPTCYP1A2CYP2D6CYP2C19
SCHEMBL29631653 0.79 ALOX5 (0.47) ALOX5TLR8L3MBTL1TP53MAPT
SCHEMBL10790400 0.77 ALDH1A1 (0.53) ALOX5L3MBTL1TP53CYP1A2CYP2C19
SCHEMBL20563008 0.76 TLR8 (0.39) ALOX5TLR8L3MBTL1CYP1A2CYP2D6
SCHEMBL1127908 0.75 TLR8 (0.50) ALOX5TLR8L3MBTL1MAPTCYP1A2
Hydrochloric Acid SCHEMBL20562447 0.75 TLR8 (0.41) ALOX5TLR8L3MBTL1MAPTKDM4E
SCHEMBL28340033 0.75 PDE10A (0.37) ALOX5TLR8L3MBTL1TP53MAPT
SCHEMBL9629388 0.74 CASP3 (0.49) ALOX5L3MBTL1TP53MAPTRXFP1

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-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2023-12-12 US disclosed
EP-3625228-B1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-07-07 EP disclosed
US-20210113559-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-04-22 US disclosed
EP-3625228-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-03-25 EP disclosed
CN-110612299-A Pyrimidine derivatives as PGE2 receptor modulators 爱杜西亚药品有限公司 2019-12-24 CN disclosed
WO-2018210988-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2018-11-22 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 (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-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators PTGER1, PTGER4, PTGER2 ALOX5 72/4885TLR8 1408/4885L3MBTL1 4507/4885
US-20210113559-A1 PYRIMIDINE DERIVATIVES AS PGE2 RECEPTOR MODULATORS PTGER1, PTGER4, PTGER2 ALOX5 72/4885TLR8 1408/4885L3MBTL1 4507/4885

“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.