SCHEMBL5555401

SCHEMBL5555401

Fc1ccc(Cl)cc1-c1nc(Cl)c2nccnc2n1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.63
PRKD3 O94806 1/20 0.63
PRKD1 Q15139 1/20 0.63
PRKD2 Q9BZL6 1/20 0.63
GRM4 Q14833 2/20 0.37
HTR2B P41595 1/20 0.35
PDE4D Q08499 1/20 0.35
KMO O15229 1/20 0.33
SLC40A1 Q9NP59 3/20 0.32
DPP4 P27487 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
IDO1 P14902 1/20 0.31
CHRM1 P11229 1/20 0.31
ALK Q9UM73 1/20 0.31
NFKBIA P25963 1/20 0.30
RELA Q04206 1/20 0.30

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
SCHEMBL8249950 0.87 PRKD3 (0.50) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL2125422 0.87 TGFBR1 (0.50) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL27712137 0.82 TGFBR1 (0.57) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL5551427 0.79 PRKD3 (0.48) TGFBR1PRKD3PRKD1PRKD2SLC40A1
SCHEMBL5555284 0.79 PRKD3 (0.45) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL29361383 0.78 TGFBR1 (1.00) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL411646 0.78 TGFBR1 (1.00) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL29381400 0.78 TGFBR1 (1.00) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL30901626 0.77 TGFBR1 (0.55) TGFBR1PRKD3PRKD1PRKD2GRM4
SCHEMBL14778537 0.77 TGFBR1 (0.55) TGFBR1PRKD3PRKD1PRKD2GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293500-A1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS, INC. 2007-12-20 US disclosed
US-20070293500-A1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS, INC. 2007-12-20 US disclosed
US-20070293500-A1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS, INC. 2007-12-20 US disclosed
US-7232824-B2 Quinazoline derivatives as medicaments SCIOS, INC. (US) 2007-06-19 US disclosed
US-7232824-B2 Quinazoline derivatives as medicaments SCIOS, INC. (US) 2007-06-19 US disclosed
US-7232824-B2 Quinazoline derivatives as medicaments SCIOS, INC. (US) 2007-06-19 US disclosed
US-20050096333-A1 Quinazoline derivatives as medicaments SCIOS, INC. 2005-05-05 US disclosed
WO-2005032481-A2 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SCIOS INC. (US) 2005-04-14 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 (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-20050096333-A1 Quinazoline derivatives as medicaments HRH4, HRH2, HRH3 TGFBR1 70/4885PRKD3 3011/4885PRKD1 3332/4885
US-20070293500-A1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SMAD3, SMAD2, TGFB2 TGFBR1 8/4885PRKD3 1661/4885PRKD1 2216/4885

“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.