SCHEMBL23885131

SCHEMBL23885131

COc1cccc(NC(=O)C(F)(F)F)c1I

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.54
PDK2 Q15119 1/20 0.54
PDK3 Q15120 1/20 0.54
PDK4 Q16654 1/20 0.54
MLYCD O95822 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ATM Q13315 1/20 0.46
KDM4E B2RXH2 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 2/20 0.43
JAK2 O60674 1/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
KLK7 P49862 1/20 0.43
RXFP1 Q9HBX9 3/20 0.43
LMNA P02545 1/20 0.43
ALOX12 P18054 1/20 0.43

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
SCHEMBL30254525 1.00 PDK1 (0.54) PDK1PDK2PDK3PDK4MLYCD
SCHEMBL1983314 0.86 KDM4E (0.57) PDK1PDK2PDK3PDK4MLYCD
SCHEMBL2226280 0.84 PDK1 (0.72) PDK1PDK2PDK3PDK4MLYCD
SCHEMBL12804315 0.82 PDK1 (0.54) PDK1PDK2PDK3PDK4MLYCD
SCHEMBL5370910 0.81 KMT2A (0.50) KMT2AMEN1MAPTLMNAGAA
SCHEMBL30254224 0.80 PDK1 (0.50) PDK1PDK2PDK3PDK4MAPT
SCHEMBL23885453 0.80 PDK1 (0.50) PDK1PDK2PDK3PDK4MAPT
SCHEMBL14337634 0.78 KMT2A (0.43) PDK1PDK2PDK3PDK4MLYCD
SCHEMBL22262468 0.78 MAPT (0.48) PDK1PDK2PDK3PDK4KDM4E
SCHEMBL29659883 0.78 MAPT (0.48) PDK1PDK2PDK3PDK4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-05-25 US disclosed
US-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-05-25 US disclosed
EP-4125914-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2023-02-08 EP disclosed
CN-115427044-A Pyrrolopyrimidines as complement inhibitors 拜奥克里斯特制药公司 2022-12-02 CN disclosed
WO-2021202977-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-10-07 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 (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-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS C5, C9, C1QBP PDK1 723/4885PDK2 796/4885PDK3 1733/4885

“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.