SCHEMBL4224601

SCHEMBL4224601

CC(C)Oc1ccc(-n2c(C(=O)O)cc3cc(Oc4cccc(Cl)c4)ccc32)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.58
GFER P55789 1/20 0.48
CCR2 P41597 2/20 0.42
MCL1 Q07820 2/20 0.41
ALDH1A1 P00352 2/20 0.41
BCL2 P10415 1/20 0.41
MDM2 Q00987 1/20 0.41
TSHR P16473 1/20 0.41
GALR3 O60755 1/20 0.40
GAA P10253 1/20 0.40
PPARG P37231 4/20 0.39
FFAR1 O14842 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
OGG1 O15527 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38

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
SCHEMBL4918706 0.92 PTGES (0.64) PTGESGFERMCL1ALDH1A1BCL2
SCHEMBL4923416 0.92 PTGES (0.60) PTGESGFERCCR2MCL1ALDH1A1
SCHEMBL4914078 0.90 PTGES (0.61) PTGESGFERCCR2MCL1ALDH1A1
SCHEMBL4924661 0.89 PTGES (0.67) PTGESGFERMCL1ALDH1A1BCL2
SCHEMBL4914068 0.87 PTGES (0.60) PTGESGFERCCR2MCL1ALDH1A1
SCHEMBL4224238 0.87 PTGES (0.45) PTGESGFERGALR3GAAHPGD
SCHEMBL4233513 0.87 HIF1A (0.48) PTGESGFERGALR3GAAPPARG
SCHEMBL4095050 0.86 PTGES (0.48) PTGESGFERCCR2MCL1ALDH1A1
SCHEMBL4094387 0.85 PTGES (0.47) PTGESMCL1ALDH1A1BCL2MDM2
SCHEMBL4921606 0.85 PTGES (0.61) PTGESGFERPPARG

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
US-20090042949-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-12 US disclosed
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 (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-20080249091-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, ARG1 PTGES 35/4885GFER 3076/4885CCR2 242/4885
US-20090042949-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PTGES 28/4885GFER 3366/4885CCR2 248/4885

“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.