SCHEMBL5555284

SCHEMBL5555284

Fc1ccc(Cl)cc1-c1nc(Cl)c2ncccc2n1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.45
TGFBR1 P36897 1/20 0.45
PRKD1 Q15139 1/20 0.45
PRKD2 Q9BZL6 1/20 0.45
TOP1 P11387 5/20 0.42
NR4A2 P43354 1/20 0.41
SLC40A1 Q9NP59 6/20 0.41
METAP1 P53582 1/20 0.39
GRM4 Q14833 2/20 0.38
CCR1 P32246 1/20 0.36
CCR8 P51685 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NFKBIA P25963 1/20 0.36
RELA Q04206 1/20 0.36
MAPT P10636 1/20 0.36
PDE4A P27815 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
SCHEMBL5555401 0.79 TGFBR1 (0.63) PRKD3TGFBR1PRKD1PRKD2SLC40A1
SCHEMBL5551427 0.77 PRKD3 (0.48) PRKD3TGFBR1PRKD1PRKD2NR4A2
SCHEMBL5551436 0.77 NR1I3 (0.48) TGFBR1TOP1NR4A2L3MBTL1MAPT
SCHEMBL3110244 0.76 CYP1A2 (0.47) TOP1METAP1CCR1CCR8L3MBTL1
SCHEMBL6833300 0.73 KDM4E (0.40) TOP1NR4A2METAP1CCR1CCR8
SCHEMBL17445466 0.72 TOP1 (0.50) TOP1METAP1
SCHEMBL17445465 0.70 NPC1 (0.41) TOP1NR4A2METAP1CCR1CCR8
SCHEMBL29907250 0.69 LMNA (0.43) TOP1NR4A2METAP1CCR1CCR8
SCHEMBL1992034 0.69 LMNA (0.43) TOP1NR4A2METAP1CCR1CCR8
SCHEMBL13649274 0.69 HTR2B (0.44) PRKD3TGFBR1PRKD1PRKD2

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 3 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-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

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 PRKD3 3011/4885TGFBR1 70/4885PRKD1 3332/4885
US-20070293500-A1 QUINAZOLINE DERIVATIVES AS MEDICAMENTS SMAD3, SMAD2, TGFB2 PRKD3 1661/4885TGFBR1 8/4885PRKD1 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.