SCHEMBL702179

SCHEMBL702179

O=C1Nc2ccc(Cl)cc2C1=Cc1ccc(Br)o1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.73
RPS6KA3 P51812 1/20 0.63
LRRK2 Q5S007 6/20 0.58
PSEN1 P49768 2/20 0.58
PSEN2 P49810 2/20 0.58
APH1B Q8WW43 2/20 0.58
NCSTN Q92542 2/20 0.58
APH1A Q96BI3 2/20 0.58
PSENEN Q9NZ42 2/20 0.58
PTPN1 P18031 4/20 0.57
PTPN2 P17706 1/20 0.57
PDGFRB P09619 1/20 0.54
MDM2 Q00987 1/20 0.54
IDO1 P14902 1/20 0.51
TDO2 P48775 1/20 0.51
TGM2 P21980 1/20 0.51

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
SCHEMBL702178 1.00 RET (0.73) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL10091765 0.87 RET (0.56) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL5369248 0.82 RET (0.65) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL10091750 0.81 RPS6KA3 (0.59) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL701928 0.81 RPS6KA3 (0.59) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL701927 0.81 RPS6KA3 (0.59) RETRPS6KA3LRRK2PSEN1PSEN2
SCHEMBL701968 0.81 POLB (0.70) RETRPS6KA3PTPN1
SCHEMBL6001779 0.81 POLB (0.70) RETRPS6KA3PTPN1
SCHEMBL701967 0.81 POLB (0.70) RETRPS6KA3PTPN1
SCHEMBL5357946 0.78 RET (0.64) RETRPS6KA3PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120190669-A1 OXINDOLE COMPOUNDS CYLENE PHARMACEUTICALS, INC. (US) 2012-07-26 US disclosed
US-8124649-B2 Oxindole compounds CYLENE PHARMACEUTICALS, INC. (US) 2012-02-28 US disclosed
EP-2307421-A1 OXINDOLE COMPOUNDS Cylene Pharmaceuticals, Inc. (US) 2011-04-13 EP disclosed
US-20100041635-A1 OXINDOLE COMPOUNDS CYLENE PHARMACEUTICALS, INC. 2010-02-18 US disclosed
WO-2010002933-A1 OXINDOLE COMPOUNDS CYLENE PHARMACEUTICALS, INC. (US) 2010-01-07 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-20100041635-A1 OXINDOLE COMPOUNDS FLT3, PIM1, PIM2 RET 164/4885RPS6KA3 290/4885LRRK2 604/4885
US-20120190669-A1 OXINDOLE COMPOUNDS FLT3, PIM1, PIM2 RET 164/4885RPS6KA3 290/4885LRRK2 604/4885

“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.