SCHEMBL4802191

SCHEMBL4802191

OCc1cc2ccccc2n1Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.59
PPARG P37231 2/20 0.51
BRD4 O60885 1/20 0.50
AGTR1 P30556 1/20 0.49
AGTR2 P50052 1/20 0.49
CYP19A1 P11511 1/20 0.47
HTT P42858 2/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 2/20 0.46
ESR1 P03372 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
SRC P12931 1/20 0.45
PLA2G10 O15496 1/20 0.45

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
SCHEMBL31402270 1.00 CCR2 (0.59) CCR2PPARGBRD4AGTR1AGTR2
SCHEMBL6705831 0.87 PPARG (0.47) CCR2PPARGAGTR1AGTR2CYP19A1
SCHEMBL8687854 0.85 POLB (0.53) CCR2PPARGPOLBLMNAKDM4E
SCHEMBL15700119 0.84 AGTR1 (0.57) CCR2PPARGBRD4AGTR1AGTR2
SCHEMBL4415758 0.83 BRD4 (0.48) CCR2PPARGBRD4HTTPOLB
SCHEMBL30005643 0.80 AGTR1 (0.53) CCR2PPARGAGTR1AGTR2CYP19A1
SCHEMBL6211323 0.79 CCR2 (0.49) CCR2PPARGBRD4ALDH1A1
SCHEMBL4438165 0.79 CCR2 (0.51) CCR2PPARGAGTR1AGTR2CYP19A1
SCHEMBL28144657 0.79 TP53 (0.52) CCR2PPARGAGTR1AGTR2CYP19A1
SCHEMBL11390081 0.79 CA12 (0.43) CCR2PPARGAGTR1AGTR2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106928121-B High-efficiency preparation method of 3-substituted-benzo five-membered heterocycle-2-carbonyl compound 暨南大学 2020-05-12 CN claimed
CN-105732470-B The high efficiency preparation method of 3- fluoro-indole-2-carbonyl compound 暨南大学 2018-07-31 CN claimed
CN-106928121-B High-efficiency preparation method of 3-substituted-benzo five-membered heterocycle-2-carbonyl compound 暨南大学 2020-05-12 CN disclosed
US-7342039-B2 Substituted indole oximes WYETH (US) 2008-03-11 US disclosed
CN-1882323-A Substituted benzofuran oximes WYETH CORP (US) 2006-12-20 CN disclosed
EP-1667670-A1 4-(1H-INDOL-3-YL-METHYLIDENEAMINOXY-PROPOXY)-BENZOIC ACID DERIVATIVES AND RELATED COMPOUNDS AS PAI-1 INHIBITORS FOR THE TREATMENT OF IMPAIREMENT OF THE FIBRINOLYTIC SYSTEM AND OF THROMBISIS Wyeth (US) 2006-06-14 EP disclosed
US-20050119326-A1 Substituted aryloximes WYETH (US) 2005-06-02 US disclosed
WO-2005030192-A1 4- (1H-INDOL-3-YL-METHYLIDENEAMINOXY-PROPOXY) -BENZIOC ACID DERIVATIVES AND RELATED COMPOUNDS AS PAI-1 INHIBITORS FOR THE TREATMENT OF IMPAIRMENT OF THE FIBRINOLYTIC SYSTEM AND OF THROMBISIS WYETH (US) 2005-04-07 WO disclosed
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 US disclosed
CN-1167111-A Thiazolidinedione derivatives, method for preparing derivatives and pharmaceutical compositions containing same SENGA PHARMACEUTICAL LAB INC (JP) 1997-12-10 CN disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP 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-20050119326-A1 Substituted aryloximes IDO2, TDO2, IDO1 CCR2 228/4885PPARG 1518/4885BRD4 213/4885

“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.