SCHEMBL20162678

SCHEMBL20162678

Nc1nc(-c2cnc3ccccc3c2)nc2[nH]ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.45
PDGFRA P16234 3/20 0.45
KDM1A O60341 1/20 0.42
AXL P30530 1/20 0.41
CDK8 P49336 1/20 0.41
MAP4K4 O95819 1/20 0.41
CSNK1G2 P78368 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
MAP4K5 Q9Y4K4 1/20 0.41
TOP2A P11388 1/20 0.41
TOP2B Q02880 1/20 0.41
PIM1 P11309 3/20 0.41
BMPR1B O00238 1/20 0.41
PIK3C2G O75747 1/20 0.41
CDKL5 O76039 1/20 0.41
TYK2 P29597 1/20 0.41
CLK2 P49760 1/20 0.41
DYRK1A Q13627 1/20 0.41
STK32B Q9NY57 1/20 0.41

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
SCHEMBL14274543 0.81 ADORA1 (0.51) CDK8MAP4K4CLK4CLK2DYRK1A
SCHEMBL12006490 0.74 BMPR1B (0.44) PDGFRBPDGFRAKDM1AMAP4K4CSNK1G2
SCHEMBL6985344 0.74 POLB (0.57) PDGFRBPDGFRAKDM1AMAP4K4CSNK1G2
SCHEMBL2694638 0.73 NUDT1 (0.70) PDGFRBPDGFRACDK8MAP4K4CLK4
SCHEMBL20162766 0.73 DHFR (0.37) DYRK1ADHFRPIK3CA
SCHEMBL1900222 0.73 CYP1A1 (0.53) DYRK1ANPC1RAB9AALDH1A1CYP1A1
SCHEMBL20162633 0.73 PIK3CA (0.46) MKNK2DHFRMAPTPIK3CA
SCHEMBL30165634 0.72 ADORA2A (0.47) KDM1ANPC1NISCHCA12CA1
SCHEMBL16497095 0.72 NUDT1 (0.43) AXLCDK8MAP4K4CLK4CLK2
SCHEMBL4156762 0.72 TGFBR1 (0.45) PDGFRBPDGFRAMAP4K4CSNK1G2CLK4

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
US-12612409-B2 Pyrrolopyrimidines as CFTR potentiators CYSTIC FIBROSIS FOUNDATION (US) 2026-04-28 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
WO-2020166680-A1 7H-PYRROLO[2,3-D]PYRIMIDINE-4-AMINE DERIVATIVE 大鵬薬品工業株式会社 2020-08-20 WO disclosed
US-20200017512-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS PFIZER INC. 2020-01-16 US disclosed
EP-3541390-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS Cystic Fibrosis Foundation Therapeutics Inc. (US) 2019-09-25 EP 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 PDGFRB 82/4885PDGFRA 121/4885KDM1A 4512/4885
US-20200017512-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 PDGFRB 82/4885PDGFRA 121/4885KDM1A 4512/4885
US-20230250100-A1 Pyrrolopyrimidines as CFTR Potentiators CFTR, P2RX1, P2RX5 PDGFRB 82/4885PDGFRA 121/4885KDM1A 4512/4885
US-12612409-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, CLCN2, SLC26A3 PDGFRB 533/4885PDGFRA 372/4885KDM1A 4865/4885
US-10301315-B2 Pyrrolopyrimidines as CFTR potentiators CFTR, P2RX1, P2RX5 PDGFRB 87/4885PDGFRA 148/4885KDM1A 4424/4885
US-20180141954-A1 PYRROLOPYRIMIDINES AS CFTR POTENTIATORS CFTR, P2RX1, P2RX5 PDGFRB 87/4885PDGFRA 148/4885KDM1A 4424/4885

“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.