SCHEMBL687464

SCHEMBL687464

Cc1[nH]c2c(c1C(=O)N(C)CCN(C)C)CCCC2=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 5/20 0.40
KDR P35968 5/20 0.40
KIT P10721 4/20 0.40
BRD4 O60885 9/20 0.37
PARP1 P09874 2/20 0.35
KIF11 P52732 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL689166 0.80 KDR (0.56) PDGFRBKDRKITALDH1A1KDM4E
SCHEMBL689469 0.78 PDGFRB (0.50) PDGFRBKDRKITALDH1A1KDM4E
SCHEMBL689067 0.75 BRD4 (0.45) BRD4ALDH1A1KDM4ELMNAHPGD
SCHEMBL12056522 0.74 PDGFRB (0.59) PDGFRBKDRKIT
SCHEMBL12056521 0.73 PDGFRB (0.77) PDGFRBKDRKIT
SCHEMBL688491 0.72 BRD4 (0.58) BRD4ALDH1A1KDM4ELMNAHPGD
SCHEMBL689169 0.71 PDGFRB (0.49) PDGFRBKDRKITBRD4ALDH1A1
SCHEMBL687485 0.70 KDR (0.61) PDGFRBKDRKITALDH1A1KDM4E
SCHEMBL689617 0.69 PDGFRB (0.54) PDGFRBKDRKITKDM4E
SCHEMBL689986 0.69 KDR (0.59) PDGFRBKDRKITALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2123649-B1 3-PYRROLO-CYCLOHEXYLENE-2-DIHYDRO-INDOLINONE DERIVATIVES AND USES THEREOF JIANGSU SIMCERE PHARMACEUTICAL R & D CO LTD (CN) 2012-02-29 EP disclosed
US-8084621-B2 3-Pyrrolo[b]cyclohexylene-2-dihydroindolinone derivatives and uses thereof Jiangsu Simcere Pharmaceutical R&D Co. Ltd. (CN) 2011-12-27 US disclosed
US-20100160318-A1 3-Pyrrolo[b]Cyclohexylene-2-Dihydroindolinone Derivatives and Uses Thereof JIANGSU SIMCERE PHARMACEUTICAL R&D CO., LTD. (CN) 2010-06-24 US disclosed
EP-2123649-A1 3-PYRROLO-CYCLOHEXYLENE-2-DIHYDRO-INDOLINONE DERIVATIVES AND USES THEREOF Jiangsu Simcere Pharmaceutical R&D Co., Ltd. (CN) 2009-11-25 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-20100160318-A1 3-Pyrrolo[b]Cyclohexylene-2-Dihydroindolinone Derivatives and Uses Thereof PTK2B, DMPK, STK25 PDGFRB 504/4885KDR 665/4885KIT 324/4885

“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.