SCHEMBL5146450

SCHEMBL5146450

CCOCc1nc2cnc3cc(Br)ccc3c2s1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
TLR8 Q9NR97 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
PTGES O14684 11/20 0.33
DHFR P00374 1/20 0.32
MAPK1 P28482 1/20 0.31
FBP1 P09467 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
EGFR P00533 1/20 0.30
ERBB2 P04626 1/20 0.30
ERBB4 Q15303 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
SCHEMBL4969106 0.86 NPC1 (0.37) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5144794 0.83 TLR8 (0.41) TLR8TLR7PTGES
SCHEMBL4965121 0.82 CYP1A2 (0.47) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL1528127 0.82 TLR8 (0.41) MEN1NPC1RAB9AKMT2ATLR8
SCHEMBL2812875 0.81 NPC1 (0.37) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL26968810 0.81 TLR8 (0.43) NPC1RAB9ATLR8TLR7PTGES
SCHEMBL29877302 0.81 TLR8 (0.43) NPC1RAB9ATLR8TLR7PTGES
SCHEMBL2808428 0.80 TRPV1 (0.38) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5146679 0.80 PTGES (0.33) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5144880 0.76 MEN1 (0.31) MEN1NPC1RAB9AKMT2ATLR8

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 MEN1 4176/4885NPC1 1672/4885RAB9A 2928/4885

“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.