SCHEMBL6087336

SCHEMBL6087336

O=C(O)CC1O/C(=C2\C(=O)Nc3cc(F)ccc32)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.40
ATM Q13315 1/20 0.38
TGM2 P21980 1/20 0.38
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PDGFRB P09619 2/20 0.34
LRRK2 Q5S007 1/20 0.34
FLT3 P36888 3/20 0.34
BACE1 P56817 1/20 0.34
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
KIT P10721 1/20 0.33
KDR P35968 1/20 0.33

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
SCHEMBL6086819 1.00 APEX1 (0.40) APEX1ATMTGM2TSHRALDH1A1
SCHEMBL13174436 1.00 APEX1 (0.40) APEX1ATMTGM2TSHRALDH1A1
SCHEMBL6086813 1.00 APEX1 (0.40) APEX1ATMTGM2TSHRALDH1A1
SCHEMBL15187524 1.00 APEX1 (0.40) APEX1ATMTGM2TSHRALDH1A1
SCHEMBL14715619 0.90 TGM2 (0.37) TGM2TSHRALDH1A1HSD17B10PDGFRB
SCHEMBL14725116 0.88 USP2 (0.41) ATMTGM2TSHRHSD17B10FLT3
SCHEMBL6086228 0.88 USP2 (0.41) ATMTGM2TSHRHSD17B10FLT3
SCHEMBL6086220 0.88 USP2 (0.41) ATMTGM2TSHRHSD17B10FLT3
SCHEMBL6087504 0.88 APEX1 (0.43) APEX1ATMTGM2TSHRALDH1A1
SCHEMBL6086671 0.88 APEX1 (0.43) APEX1ATMTGM2TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490356-B1 (3Z)-3-(3-HYDRO-ISOBENZOFURAN-1-YLIDENE)-1,3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN INC (US) 2013-02-27 EP claimed
EP-1490356-B1 (3Z)-3-(3-HYDRO-ISOBENZOFURAN-1-YLIDENE)-1,3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN INC (US) 2013-02-27 EP disclosed
US-7060844-B2 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. (US) 2006-06-13 US disclosed
US-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-01-05 US disclosed
EP-1490356-A1 (3Z)-3-(3-HYDRO-ISOBENZOFURAN-1-YLIDENE)-1,3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS Allergan, Inc. (US) 2004-12-29 EP disclosed
US-20040019098-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2004-01-29 US disclosed
WO-2003084951-A1 (3Z) -3-(3-HYDRO-ISOBENZOFURAN-1-YLIDENE)-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN, INC. (US) 2003-10-16 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 (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-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors CDK2, ERBB2, MAP3K3 APEX1 4151/4885ATM 782/4885TGM2 3264/4885
US-20040019098-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors CDK2, ERBB2, MAP3K3 APEX1 4077/4885ATM 774/4885TGM2 3164/4885

“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.