SCHEMBL4996497

SCHEMBL4996497

CC1CN(c2ccc(NC=C3C(=O)Nc4cccc(F)c43)cc2F)CC(C)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
USP30 Q70CQ3 1/20 0.37
KDM4E B2RXH2 4/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 2/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 4/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 1/20 0.32
PDGFRB P09619 2/20 0.32
ERBB2 P04626 1/20 0.32
RET P07949 1/20 0.32
EGFR P00533 2/20 0.31
PDGFRA P16234 1/20 0.31
KDR P35968 1/20 0.31
BTK Q06187 1/20 0.31
TYK2 P29597 2/20 0.31

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
SCHEMBL4996493 1.00 PDE3B (0.42) PDE3BPDE3AUSP30KDM4EHTT
SCHEMBL4999297 0.93 PDE3B (0.41) PDE3BPDE3AUSP30KDM4EHTT
SCHEMBL4999526 0.93 PDE3B (0.37) PDE3BPDE3AUSP30KDM4EHTT
SCHEMBL4999530 0.93 PDE3B (0.37) PDE3BPDE3AUSP30KDM4EHTT
SCHEMBL4999302 0.93 PDE3B (0.41) PDE3BPDE3AUSP30KDM4EHTT
SCHEMBL4988757 0.91 PDE3B (0.36) PDE3BPDE3AUSP30KDM4ELMNA
SCHEMBL4988759 0.91 PDE3B (0.36) PDE3BPDE3AUSP30KDM4ELMNA
SCHEMBL4993923 0.90 GHSR (0.36) PDGFRBEGFRPDGFRAKDRTYK2
SCHEMBL4993929 0.90 GHSR (0.36) PDGFRBEGFRPDGFRAKDRTYK2
SCHEMBL4994616 0.90 POLB (0.33) PDE3BPDE3AKDM4EPDGFRBERBB2

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
US-7414054-B2 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. (US) 2008-08-19 US disclosed
US-20060194863-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-08-31 US disclosed
US-20060063940-A1 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-03-23 US disclosed
US-20060025413-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-02-02 US disclosed
US-6765012-B2 FOR MODULATING TYROSINE KINASE SIGNAL TRANSDUCTION IN ORDER TO REGULATE, MODULATE AND/OR INHIBIT ABNORMAL CELL PROLIFERATION ALLERGAN, INC. 2004-07-20 US disclosed
EP-1430048-A1 3-(ARYLAMINO)METHYLENE-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS Allergan, Inc. (US) 2004-06-23 EP disclosed
US-20030225152-A1 3-(Arylamino)methylene-1, 3-dihydro-2h-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2003-12-04 US disclosed
US-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2003-10-23 US disclosed
WO-2003027102-A1 3-(ARYLAMINO)METHYLENE-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN, INC. (US) 2003-04-03 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 (5 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-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 PDE3B 2731/4885PDE3A 2654/4885USP30 2930/4885
US-20060194863-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 PDE3B 2731/4885PDE3A 2654/4885USP30 2930/4885
US-20060025413-A1 3-(arylamino)methylene-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 PDE3B 2731/4885PDE3A 2654/4885USP30 2930/4885
US-20060063940-A1 3-(arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 PDE3B 2731/4885PDE3A 2654/4885USP30 2930/4885
US-20030225152-A1 3-(Arylamino)methylene-1, 3-dihydro-2h-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 PDE3B 2731/4885PDE3A 2654/4885USP30 2930/4885

“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.