SCHEMBL29804792

SCHEMBL29804792

Cc1ccc(-c2ccc3ncncc3c2)nc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.51
PIK3CD O00329 1/20 0.51
FGFR4 P22455 1/20 0.48
EGFR P00533 9/20 0.47
TDO2 P48775 1/20 0.47
CCR1 P32246 1/20 0.46
CCR5 P51681 1/20 0.46
CCR8 P51685 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2A6 P11509 1/20 0.45
GRIA2 P42262 1/20 0.37
GRM5 P41594 1/20 0.36
POLQ O75417 1/20 0.36
METAP2 P50579 1/20 0.36

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
SCHEMBL3535171 0.83 PIK3CA (0.61) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL29804751 0.81 PIK3CA (0.54) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL29985188 0.79 EGFR (0.60) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL1771905 0.79 EGFR (0.60) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL8644295 0.79 PIK3CA (0.73) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL12386956 0.78 ALDH1A1 (0.62) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL28801910 0.78 EGFR (0.58) PIK3CAPIK3CDFGFR4EGFRTDO2
SCHEMBL20929593 0.76 CCR1 (0.56) CCR1CCR5CCR8HDAC6CYP3A4
SCHEMBL12386961 0.76 CYP3A4 (0.54) PIK3CAPIK3CDTDO2CCR1CCR5
SCHEMBL12386963 0.76 CYP3A4 (0.54) PIK3CAPIK3CDEGFRTDO2CCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466820-B2 Amino quinazoline derivatives as P2X3 inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2025-11-11 US disclosed
US-20220227749-A1 AMINO QUINAZOLINE DERIVATIVES AS P2X3 INHIBITORS CHARLES RIVER LABORATORIES, INC. 2022-07-21 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-20220227749-A1 AMINO QUINAZOLINE DERIVATIVES AS P2X3 INHIBITORS P2RX3, P2RX5, P2RX1 PIK3CA 627/4885PIK3CD 521/4885FGFR4 1926/4885
US-12466820-B2 Amino quinazoline derivatives as P2X3 inhibitors P2RX3, P2RX5, P2RX1 PIK3CA 627/4885PIK3CD 521/4885FGFR4 1926/4885

“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.