SCHEMBL20175298

SCHEMBL20175298

COc1cc(C#N)cc(-c2cn(Cc3cn(-c4ccccc4F)nn3)c3ncnc(N)c23)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 11/20 0.42
CFTR P13569 2/20 0.40
ABL1 P00519 8/20 0.40
EGFR P00533 8/20 0.40
ABL2 P42684 8/20 0.40
LRRK2 Q5S007 2/20 0.40
CDK1 P06493 1/20 0.40
LCK P06239 3/20 0.39
RIPK2 O43353 1/20 0.38
KDR P35968 2/20 0.38
IGF1R P08069 1/20 0.38
FGFR1 P11362 1/20 0.37
FGFR4 P22455 1/20 0.37
TEK Q02763 2/20 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
SCHEMBL20173311 0.90 CFTR (0.42) SRCCFTRLRRK2LCKRIPK2
SCHEMBL20173321 0.86 SRC (0.52) SRCABL1EGFRABL2LCK
SCHEMBL20173314 0.86 CFTR (0.40) SRCCFTR
SCHEMBL20173318 0.85 TEK (0.41) SRCCFTRABL1EGFRABL2
SCHEMBL20181897 0.83 SRC (0.42) SRCCFTRABL1EGFRABL2
SCHEMBL20162676 0.79 CFTR (0.41) SRCCFTRABL1EGFRABL2
SCHEMBL30037231 0.79 CFTR (0.44) SRCCFTRLCK
SCHEMBL20162718 0.79 CFTR (0.44) SRCCFTRLCK
SCHEMBL30037245 0.79 CFTR (0.41) SRCCFTRABL1EGFRABL2
SCHEMBL30037644 0.79 PTGS2 (0.45) SRCCFTR

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-4424311-A2 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS Cystic Fibrosis Foundation (US) 2024-09-04 EP disclosed
EP-3541390-B1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUND (US) 2024-05-01 EP disclosed
US-20230250100-A1 Pyrrolopyrimidines as CFTR Potentiators CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. 2023-08-10 US disclosed
US-20210171534-A1 Pyrrolopyrimidines as CFTR Potentiators CYSTIC FIBROSIS FOUNDATION 2021-06-10 US disclosed
US-20200017512-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS PFIZER INC. 2020-01-16 US disclosed
US-20190225621-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION 2019-07-25 US disclosed
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) 2019-05-28 US disclosed
WO-2018094137-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) 2018-05-24 WO disclosed
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) 2018-05-24 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 (6 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-20210171534-A1 Pyrrolopyrimidines as CFTR Potentiators CFTR, P2RX1, P2RX5 SRC 3551/4885CFTR 1/4885ABL1 3977/4885
US-20200017512-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 SRC 3551/4885CFTR 1/4885ABL1 3977/4885
US-20190225621-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 SRC 3551/4885CFTR 1/4885ABL1 3977/4885
US-20230250100-A1 Pyrrolopyrimidines as CFTR Potentiators CFTR, P2RX1, P2RX5 SRC 3551/4885CFTR 1/4885ABL1 3977/4885
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, P2RX1, P2RX5 SRC 3742/4885CFTR 1/4885ABL1 4124/4885
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 SRC 3742/4885CFTR 1/4885ABL1 4124/4885

“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.