SCHEMBL3137262

SCHEMBL3137262

Cc1ccc2oc(-c3cc(Br)ccc3OCC=Cc3ccccc3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.46
KDM4E B2RXH2 7/20 0.46
HPGD P15428 7/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
NPC1 O15118 6/20 0.46
CASP3 P42574 4/20 0.46
SENP7 Q9BQF6 4/20 0.46
SENP6 Q9GZR1 4/20 0.46
SENP8 Q96LD8 3/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 8/20 0.43
XBP1 P17861 1/20 0.43
HIF1A Q16665 1/20 0.43
AGPAT2 O15120 3/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 6/20 0.41
TP53 P04637 6/20 0.41
HSD17B10 Q99714 5/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL3137253 1.00 RAB9A (0.46) RAB9AKDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3131839 0.88 KDM4E (0.46) RAB9AKDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3131850 0.88 KDM4E (0.46) RAB9AKDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3137505 0.88 MAPT (0.41) RAB9AKDM4ESMN1; SMN2NPC1POLB
SCHEMBL3137514 0.88 MAPT (0.41) RAB9AKDM4ESMN1; SMN2NPC1POLB
SCHEMBL3136330 0.83 KDM4E (0.50) RAB9AKDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3131878 0.76 PTGES (0.69) RAB9AKDM4EHPGDNPC1MAPT
SCHEMBL3130870 0.76 PTGES (0.48) RAB9AKDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3131870 0.76 PTGES (0.69) RAB9AKDM4EHPGDNPC1MAPT
SCHEMBL3130864 0.76 PTGES (0.48) RAB9AKDM4EHPGDSMN1; SMN2NPC1

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-20100004301-A1 Benzoxazoles Useful in the Treatment of Inflammation BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-07 US disclosed
EP-2102177-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION Boehringer Ingelheim International GmbH (DE) 2009-09-23 EP disclosed
WO-2008071944-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-06-19 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-20100004301-A1 Benzoxazoles Useful in the Treatment of Inflammation IL4I1, EPX, IL4 RAB9A 3680/4885KDM4E 1264/4885HPGD 411/4885

“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.