SCHEMBL22924876

SCHEMBL22924876

COC(=O)C(C)(C)c1cc(C(F)(F)F)nc(Cl)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.36
MAPT P10636 1/20 0.36
ATF1 P18846 1/20 0.35
NFKB1 P19838 1/20 0.35
CNR2 P34972 2/20 0.34
MAPK1 P28482 2/20 0.34
GPR35 Q9HC97 1/20 0.34
SDHB P21912 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.34
P2RX3 P56373 1/20 0.34
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HIF1A Q16665 1/20 0.33
MITF O75030 1/20 0.33
S1PR4 O95977 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL30882872 0.84 KDM4E (0.35) ATF1NFKB1CNR2SMN1; SMN2KDM4E
SCHEMBL22924930 0.84 KDM4E (0.35) ATF1NFKB1CNR2SMN1; SMN2KDM4E
SCHEMBL22924882 0.83 ALDH1A1 (0.43) MAPTCNR2MAPK1SMN1; SMN2KDM4E
SCHEMBL21381400 0.81 ALDH1A1 (0.41) MAPTCNR2SMN1; SMN2KDM4ELMNA
SCHEMBL16095194 0.76 MAPT (0.46) MAPTSDHBSMN1; SMN2KDM4ELMNA
SCHEMBL6468496 0.75 NT5E (0.42) SMN1; SMN2KDM4EALDH1A1HPGDCYP1A2
SCHEMBL31216589 0.74 P2RX7 (0.47) MAPK1SDHBP2RX3
SCHEMBL21392326 0.74 CTPS1 (0.54)
SCHEMBL21373779 0.73 PLCG1 (0.41) MAPTCNR2LMNAALDH1A1NPSR1
SCHEMBL21392139 0.73 KDM4E (0.47) MAPTL3MBTL1SMN1; SMN2TP53KDM4E

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-3768674-B1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S A S (FR) 2024-01-03 EP disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 US disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 US disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 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-20210024507-A1 Compounds CYP1A1, UGT1A1, CYP1A2 IGF1R 2570/4885MAPT 2116/4885ATF1 2256/4885
US-20230192673-A1 Compounds CYP1A1, UGT1A1, CYP1A2 IGF1R 2570/4885MAPT 2116/4885ATF1 2256/4885

“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.