SCHEMBL2949005

SCHEMBL2949005

N#Cc1cc(CC(=O)O)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
KDM4E B2RXH2 3/20 0.61
MAPT P10636 3/20 0.61
HPGD P15428 3/20 0.61
HSD17B10 Q99714 3/20 0.61
TSHR P16473 2/20 0.61
NFKB1 P19838 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
RGS12 O14924 1/20 0.61
LMNA P02545 1/20 0.61
POLB P06746 1/20 0.61
APEX1 P27695 1/20 0.61
THPO P40225 1/20 0.61
BLM P54132 1/20 0.61
GNAI1 P63096 1/20 0.61
PMP22 Q01453 1/20 0.61
HIF1A Q16665 1/20 0.61
CA2 P00918 2/20 0.56
ALDH1A1 P00352 3/20 0.51
RXRA P19793 2/20 0.49

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
SCHEMBL29180205 0.85 RXRA (0.55) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL18554424 0.81 CA2 (0.54) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL2728379 0.81 RXRA (0.51) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL30488171 0.81 CA2 (0.54) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL13665106 0.80 GAA (0.60) GAAKDM4EMAPTHPGDTSHR
SCHEMBL5747672 0.80 ERCC1 (0.45) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL2723164 0.77 CA2 (0.59) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL2723601 0.77 RXRA (0.51) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL297462 0.77 RXRA (0.55) GAAKDM4EMAPTHPGDHSD17B10
SCHEMBL30578193 0.77 RXRA (0.55) GAAKDM4EMAPTHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1489078-B1 BENZOFURAN DERIVATIVE MITSUBISHI TANABE PHARMA CORP (JP) 2010-01-06 EP disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20060247273-A1 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-11-02 US disclosed
EP-1666478-A1 CARBAMOYL-TYPE BENZOFURAN DERIVATIVES TANABE SEIYAKU CO., LTD. (JP) 2006-06-07 EP disclosed
EP-1644362-A2 INDOLINONE HYDRAZIDES AS C-MET INHIBITORS Sugen, Inc. (US) 2006-04-12 EP disclosed
US-20060009493-A1 Indolinone hydrazides as c-Met inhibitors SUGEN, INC. 2006-01-12 US disclosed
WO-2005005378-A2 INDOLINONE HYDRAZIDES AS C-MET INHIBITORS SUGEN, INC. (US) 2005-01-20 WO disclosed
EP-1489078-A1 BENZOFURAN DERIVATIVE Tanabe Seiyaku Co., Ltd. (JP) 2004-12-22 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 (3 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-20060247273-A1 Carbamoyl-type benzofuran derivatives F12, F2, F3 GAA 3498/4885KDM4E 204/4885MAPT 4544/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 GAA 3844/4885KDM4E 1464/4885MAPT 4681/4885
US-20060009493-A1 Indolinone hydrazides as c-Met inhibitors MET, IGF1R, ROS1 GAA 3630/4885KDM4E 861/4885MAPT 3977/4885

“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.