SCHEMBL504146

SCHEMBL504146

O=C(O)Cc1c(C(=O)O)c2cc(Oc3ccc(OC4CCCC4)cc3)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
EPHX2 P34913 1/20 0.38
THRA P10827 2/20 0.36
THRB P10828 2/20 0.36
FFAR1 O14842 4/20 0.36
HRH3 Q9Y5N1 6/20 0.35
KCNH2 Q12809 1/20 0.35
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
AGTR1 P30556 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL503508 0.99 MEN1 (0.41) USP14MEN1KMT2AKDM4EEPHX2
SCHEMBL10051929 0.93 USP14 (0.39) USP14MEN1KMT2AKDM4EFFAR1
SCHEMBL503883 0.93 EPHX2 (0.41) USP14MEN1KMT2AKDM4EEPHX2
SCHEMBL504103 0.92 EPHX2 (0.41) USP14MEN1KMT2AKDM4EEPHX2
SCHEMBL503483 0.84 IDH1 (0.36) USP14MEN1KMT2AKDM4E
SCHEMBL10051928 0.80 KDM4E (0.57) USP14MEN1KMT2AKDM4EALDH1A1
SCHEMBL504228 0.79 EPHX2 (0.39) USP14KDM4EEPHX2ALDH1A1
SCHEMBL333485 0.79 USP14 (0.56) USP14MEN1KMT2AFFAR1ALDH1A1
SCHEMBL334162 0.79 USP14 (0.52) USP14MEN1KMT2AKDM4ETHRB
SCHEMBL10076916 0.78 PPARG (0.47) USP14MEN1KMT2AKDM4EEPHX2

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-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 US disclosed
US-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 US disclosed
US-20120029016-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SW) 2012-02-02 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 (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-20120029016-A1 Indoles Useful in the Treatment of Inflammation LTC4S, LTB4R2, LTB4R USP14 2929/4885MEN1 2934/4885KMT2A 1783/4885

“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.