SCHEMBL4500237

SCHEMBL4500237

Cc1ccc2oc(-c3cc(N)ccc3C)nc2c1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 16/20 0.89
KDM4E B2RXH2 13/20 0.89
MAPT P10636 13/20 0.89
SMN1; SMN2 Q16637 12/20 0.89
ALDH1A1 P00352 12/20 0.89
HPGD P15428 9/20 0.89
HSD17B10 Q99714 7/20 0.89
GAA P10253 3/20 0.89
CASP3 P42574 3/20 0.89
SENP7 Q9BQF6 3/20 0.89
SENP6 Q9GZR1 3/20 0.89
SENP8 Q96LD8 2/20 0.89
NPC1 O15118 15/20 0.74
TP53 P04637 8/20 0.68
TSHR P16473 1/20 0.68
NFKB1 P19838 2/20 0.62
NFKB2 Q00653 2/20 0.62
RELA Q04206 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
AGPAT2 O15120 1/20 0.57

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
SCHEMBL12643346 0.88 RAB9A (0.89) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL30831358 0.88 RAB9A (0.70) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL2491850 0.86 MAPT (0.70) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL7258748 0.86 RAB9A (0.67) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL14699734 0.84 KDM4E (0.68) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL2035125 0.81 RAB9A (1.00) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL474369 0.80 RAB9A (0.82) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL31154077 0.80 RAB9A (0.82) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL14148310 0.80 RAB9A (0.73) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL28579942 0.80 RAB9A (0.86) RAB9AKDM4EMAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090258917-A1 Benzoxazoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-10-15 US disclosed
EP-1933834-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2008-06-25 EP disclosed
WO-2007042816-A1 BENZOXAZOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2007-04-19 WO disclosed
WO-2002036580-A9 BENZOXAZOLE LPAAT- BETA INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2003-02-13 WO disclosed
US-20020107269-A1 Benzoxazole LPAAT-B inhibitors and uses thereof CELL THERAPEUTICS, INC. 2002-08-08 US disclosed
WO-2002036580-A2 BENZOXAZOLE LPAAT- BETA INHIBITORS AND USES THEREOF BONHAM LYNN (US) 2002-05-10 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-20020107269-A1 Benzoxazole LPAAT-B inhibitors and uses thereof LPCAT3, LPCAT1, PLAAT2 RAB9A 3729/4885KDM4E 1501/4885MAPT 4105/4885
US-20090258917-A1 Benzoxazoles Useful in the Treatment of Inflammation IL4I1, EPX, IL4 RAB9A 3680/4885KDM4E 1264/4885MAPT 270/4885

“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.