SCHEMBL20173322

SCHEMBL20173322

CC(c1cc(-c2ccccc2F)no1)n1cc(-c2ccc3c(c2)C(=O)N(C)C3)c2c(N)ncnc21

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.42
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
PRKDC P78527 1/20 0.40
KDR P35968 7/20 0.39
TEK Q02763 7/20 0.39
LCK P06239 5/20 0.39
SRC P12931 1/20 0.39
EIF2AK3 Q9NZJ5 1/20 0.39
FLT3 P36888 1/20 0.37
NEK7 Q8TDX7 4/20 0.36
CFTR P13569 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
SCHEMBL31099161 1.00 RET (0.42) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20162649 0.83 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30538106 0.83 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20162651 0.83 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30037546 0.83 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20173324 0.83 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20173325 0.82 KDR (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20173328 0.81 KDR (0.45) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20162640 0.80 RET (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20162645 0.80 RET (0.46) RETPIK3CDPIK3CAPIK3CBPIK3CG

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-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-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
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CYSTIC FIBROSIS FOUNDATION THERAPEUTICS, INC. (US) 2018-05-24 US 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 RET 916/4885PIK3CD 1554/4885PIK3CA 524/4885
US-20200017512-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 RET 916/4885PIK3CD 1554/4885PIK3CA 524/4885
US-20190225621-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 RET 916/4885PIK3CD 1554/4885PIK3CA 524/4885
US-20230250100-A1 Pyrrolopyrimidines as CFTR Potentiators CFTR, P2RX1, P2RX5 RET 916/4885PIK3CD 1554/4885PIK3CA 524/4885
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, P2RX1, P2RX5 RET 962/4885PIK3CD 1532/4885PIK3CA 547/4885
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 RET 962/4885PIK3CD 1532/4885PIK3CA 547/4885

“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.