SCHEMBL4916779

SCHEMBL4916779

CC(C)Oc1ccc(-n2c(C(=O)O)cc3ccc(Oc4ccc(Cl)c(Cl)c4)cc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.53
CCR2 P41597 6/20 0.46
KMO O15229 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
ABCB11 O95342 1/20 0.40
BCL2 P10415 2/20 0.39
MDM2 Q00987 2/20 0.39
MCL1 Q07820 2/20 0.39
KMT2A Q03164 1/20 0.38
PTGDR Q13258 3/20 0.37
FFAR1 O14842 1/20 0.37
NOTUM Q6P988 1/20 0.37

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
SCHEMBL4914068 0.91 PTGES (0.60) PTGESCCR2KMOALDH1A1TSHR
SCHEMBL4912640 0.83 PTGES (0.53) PTGESALDH1A1TSHRBCL2MDM2
SCHEMBL4922695 0.83 PTGES (0.48) PTGESALDH1A1TSHRBCL2MDM2
SCHEMBL4924661 0.82 PTGES (0.67) PTGESALDH1A1TSHRBCL2MDM2
SCHEMBL3574822 0.82 PTGES (0.71) PTGESALDH1A1TSHRBCL2MDM2
SCHEMBL4914078 0.81 PTGES (0.61) PTGESCCR2ALDH1A1TSHRABCB11
SCHEMBL4926174 0.81 PLA2G10 (0.52) PTGES
SCHEMBL4923416 0.80 PTGES (0.60) PTGESCCR2ALDH1A1TSHRABCB11
SCHEMBL4224601 0.79 PTGES (0.58) PTGESCCR2ALDH1A1TSHRBCL2
SCHEMBL4918706 0.79 PTGES (0.64) PTGESALDH1A1TSHRBCL2MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249091-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-10-09 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-20080249091-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, ARG1 PTGES 35/4885CCR2 242/4885KMO 368/4885

“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.