SCHEMBL5738720

SCHEMBL5738720

CCOC(=O)c1cc2cc(-c3ccc(OC(C)C)cc3)ccc2n1Cc1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOD2 Q9HC29 1/20 0.49
NOD1 Q9Y239 1/20 0.49
CCR2 P41597 8/20 0.48
F10 P00742 3/20 0.48
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.46
ATM Q13315 1/20 0.46
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ABCB1 P08183 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PLA2G2A P14555 1/20 0.42
P2RX3 P56373 1/20 0.42
PTGES O14684 1/20 0.42

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
SCHEMBL5750477 0.89 CCR2 (0.62) CCR2ABCB1PTGES
SCHEMBL4094156 0.85 PTGES (0.43) NOD2NOD1CCR2F10MAPT
SCHEMBL6782501 0.84 ABCB11 (0.58) NOD2NOD1CCR2F10MAPT
SCHEMBL6307843 0.80 NOD2 (0.74) NOD2NOD1CCR2F10MAPT
SCHEMBL1503984 0.80 NOD2 (0.67) NOD2NOD1CCR2F10MAPT
SCHEMBL3201430 0.79 NOD2 (0.63) NOD2NOD1CCR2F10MAPT
SCHEMBL4942946 0.78 NOD2 (0.56) NOD2NOD1CCR2F10MAPT
SCHEMBL3581409 0.78 PTGES (0.59) NOD2NOD1MAPTTDP1ALDH1A1
SCHEMBL6302520 0.77 CCR2 (0.75) NOD2NOD1CCR2F10MAPT
SCHEMBL3575712 0.76 PTGES (0.64) MAPTALDH1A1POLBTSHRATM

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-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 US disclosed
EP-1646624-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2006-04-19 EP disclosed
WO-2005005415-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-01-20 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 (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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 NOD2 1316/4885NOD1 834/4885CCR2 377/4885

“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.