SCHEMBL3345929

SCHEMBL3345929

Cc1[nH]c2c(c1C(=O)N1CCC(N3CCCCC3)CC1)CCCC2=O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.58
KIT P10721 1/20 0.58
KDR P35968 1/20 0.58
L3MBTL3 Q96JM7 15/20 0.48
L3MBTL1 Q9Y468 14/20 0.48
MBTD1 Q05BQ5 5/20 0.45
TP53BP1 Q12888 2/20 0.43
L3MBTL4 Q8NA19 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL688614 0.80 PDGFRB (0.42) PDGFRBKITKDRMEN1ALDH1A1
SCHEMBL688901 0.79 PDGFRB (0.55) PDGFRBKITKDRKDM4EALDH1A1
SCHEMBL688926 0.75 PDGFRB (0.41) PDGFRBKITKDRALDH1A1KMT2A
SCHEMBL689067 0.71 BRD4 (0.45) KDM4EMEN1ALDH1A1KMT2A
SCHEMBL689002 0.68 PDGFRB (0.58) PDGFRBKITKDRL3MBTL1KDM4E
SCHEMBL1085278 0.67 L3MBTL3 (0.65) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL5628863 0.66 PDGFRB (0.56) PDGFRBKITKDRMEN1KMT2A
SCHEMBL688491 0.65 BRD4 (0.58) L3MBTL1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL688015 0.64 PDGFRB (0.59) PDGFRBKITKDRL3MBTL1KDM4E
SCHEMBL687464 0.64 PDGFRB (0.40) PDGFRBKITKDRKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 504/4885KIT 324/4885KDR 665/4885

“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.