SCHEMBL4504622

SCHEMBL4504622

CN1CCN(C(=O)c2ccc(NC(=C3C(=O)Nc4cc(Cl)ccc43)c3ccccc3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 5/20 0.47
PIM2 Q9P1W9 5/20 0.47
POLB P06746 2/20 0.47
KMT2A Q03164 1/20 0.44
FLT3 P36888 2/20 0.44
PIM3 Q86V86 1/20 0.44
CYP2C9 P11712 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
NAMPT P43490 3/20 0.43
EPHX2 P34913 2/20 0.43
PDGFRB P09619 1/20 0.42
SRC P12931 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ABL1 P00519 1/20 0.41
GRM5 P41594 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
SCHEMBL4504619 1.00 PIM1 (0.47) PIM1PIM2POLBKMT2AFLT3
SCHEMBL4498302 0.92 POLB (0.46) PIM1PIM2POLBKMT2AFLT3
SCHEMBL4498298 0.92 POLB (0.46) PIM1PIM2POLBKMT2AFLT3
SCHEMBL4505664 0.91 POLB (0.46) PIM1PIM2POLBKMT2AFLT3
SCHEMBL4505669 0.91 POLB (0.46) PIM1PIM2POLBKMT2AFLT3
SCHEMBL3847376 0.91 CDK5 (0.47) PIM1PIM2POLBFLT3CYP2C9
SCHEMBL4486642 0.91 NPC1 (0.52) PIM1PIM2KMT2AFLT3LMNA
SCHEMBL4486638 0.91 NPC1 (0.52) PIM1PIM2KMT2AFLT3LMNA
SCHEMBL4491108 0.90 PIM1 (0.45) PIM1PIM2POLBKMT2AFLT3
SCHEMBL4491113 0.90 PIM1 (0.45) PIM1PIM2POLBKMT2AFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 US 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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR PIM1 895/4885PIM2 1326/4885POLB 4146/4885

“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.