SCHEMBL2377024

SCHEMBL2377024

COc1ccc(CN(Cc2ccc(OC)cc2)c2c(F)cc(B3OC(C)(C)C(C)(C)O3)cc2F)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
LPL P06858 6/20 0.38
LIPG Q9Y5X9 6/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
PYCR1 P32322 1/20 0.36
UCHL1 P09936 1/20 0.36
HIF1A Q16665 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL2377471 0.85 SNCA (0.42) SNCALMNAMAPTLPLLIPG
SCHEMBL24696660 0.85 DGAT1 (0.38) SNCALMNAMAPTLPLLIPG
SCHEMBL30039774 0.85 DGAT1 (0.38) SNCALMNAMAPTLPLLIPG
SCHEMBL18645616 0.80 SNCA (0.43) SNCALMNAMAPTLPLLIPG
SCHEMBL18644305 0.80 SNCA (0.43) SNCALMNAMAPTLPLLIPG
SCHEMBL2376356 0.79 LMNA (0.47) SNCALMNAMAPTLPLLIPG
SCHEMBL22775936 0.78 SNCA (0.38) SNCALMNAMAPTUCHL1QPCT
SCHEMBL189658 0.78 DGAT1 (0.40) SNCALPLLIPGMEN1KMT2A
SCHEMBL30220346 0.77 SNCA (0.42) SNCALMNAMAPTLPLLIPG
SCHEMBL21054557 0.77 DGAT1 (0.43) SNCALPLLIPGHIF1ADGAT1

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-2050749-B1 PYRIMIDINE DERIVATIVE AS PI3K INHIBITOR AND USE THEREOF CHUGAI PHARMACEUTICAL CO LTD (JP) 2017-11-22 EP disclosed
US-8022205-B2 Pyrimidine derivatives as PI3K inhibitor and use thereof CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-09-20 US disclosed
US-20100069629-A1 PYRIMIDINE DERIVATIVES AS PI3K INHIBITOR AND USE THEREOF CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-03-18 US disclosed
EP-2050749-A1 PYRIMIDINE DERIVATIVE AS PI3K INHIBITOR AND USE THEREOF CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-04-22 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-20100069629-A1 PYRIMIDINE DERIVATIVES AS PI3K INHIBITOR AND USE THEREOF PIK3CA, AKT3, AKT1 SNCA 4547/4885LMNA 4407/4885MAPT 4385/4885

“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.