SCHEMBL4700259

SCHEMBL4700259

CCOC(=O)c1c(N2CCOCC2)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.41
PTGES O14684 2/20 0.41
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 1/20 0.40
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
THRB P10828 1/20 0.39
POLB P06746 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
KDM4E B2RXH2 2/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
LMNA P02545 3/20 0.37
CD274 Q9NZQ7 1/20 0.37
TSHR P16473 1/20 0.36
MTOR P42345 1/20 0.36

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
SCHEMBL27679338 0.91 BTK (0.40) BTKMAPTSMN1; SMN2USP2TP53
SCHEMBL4698604 0.90 PTGES (0.47) PTGESMAPTHSD17B10POLBLMNA
SCHEMBL4698400 0.83 PTGES (0.45) PTGESMAPTSMN1; SMN2TP53THRB
SCHEMBL3000522 0.81 PTGES (0.48) PTGESMAPTSMN1; SMN2RAB9AMAPK1
SCHEMBL3000528 0.79 PTGES (0.42) PTGESMAPTSMN1; SMN2RAB9AUSP2
SCHEMBL3007903 0.77 PTGES (0.43) PTGESMAPTSMN1; SMN2TP53THRB
SCHEMBL4021254 0.77 PTGES (0.59) PTGESMAPTSMN1; SMN2TP53THRB
SCHEMBL4698398 0.76 PTGES (0.55) PTGESMAPTSMN1; SMN2RAB9ATP53
SCHEMBL3575288 0.76 PTGES (0.44) PTGESMAPTSMN1; SMN2TP53THRB
SCHEMBL3001790 0.75 KDM4E (0.40) PTGESMAPTSMN1; SMN2RAB9ATP53

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
EP-1778633-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-12-03 EP disclosed
US-20080188473-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-08-07 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-20080188473-A1 Indoles Useful in the Treatment of Inflammation IDO1, PTGS1, PTGER1 BTK 3313/4885PTGES 4/4885MAPT 3535/4885

“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.