SCHEMBL5146679

SCHEMBL5146679

COCCc1nc2cnc3cc(Br)ccc3c2s1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 9/20 0.33
EGFR P00533 1/20 0.32
ERBB2 P04626 1/20 0.32
FBP1 P09467 2/20 0.32
GAK O14976 1/20 0.32
ALDH1A1 P00352 1/20 0.31
PTGER4 P35408 1/20 0.31
MMP1 P03956 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.30
HTT P42858 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
SCHEMBL5144794 0.86 TLR8 (0.41) PTGESHTT
SCHEMBL26968810 0.84 TLR8 (0.43) PTGESNPC1RAB9AHTT
SCHEMBL29877302 0.84 TLR8 (0.43) PTGESNPC1RAB9AHTT
SCHEMBL4969106 0.81 NPC1 (0.37) PTGESMEN1NPC1RAB9AKMT2A
SCHEMBL2808428 0.80 TRPV1 (0.38) PTGESMEN1NPC1RAB9AKMT2A
SCHEMBL5146450 0.80 MEN1 (0.35) PTGESEGFRERBB2FBP1ALDH1A1
SCHEMBL5146563 0.78 TLR8 (0.51) PTGES
SCHEMBL4965121 0.77 CYP1A2 (0.47) PTGESALDH1A1MEN1NPC1RAB9A
SCHEMBL24365935 0.77 TRPV1 (0.44) MEN1NPC1RAB9AKMT2A
SCHEMBL32689351 0.77 TRPV1 (0.44) MEN1NPC1RAB9AKMT2A

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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-11-08 US disclosed
WO-2006093514-A2 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-08 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 (1 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-20070259907-A1 ARYL AND ARYLALKYLENYL SUBSTITUTED THIAZOLOQUINOLINES AND THIAZOLONAPHTHYRIDINES IL2, TSLP, IFNG PTGES 574/4885EGFR 943/4885ERBB2 460/4885

“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.