SCHEMBL4489119

SCHEMBL4489119

CN1CCN(C(=O)c2ccc(N/C(=C3\C(=O)Nc4cc(Cl)ccc43)c3cccc(CC(=O)O)c3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 5/20 0.46
PIM2 Q9P1W9 5/20 0.46
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
FLT3 P36888 1/20 0.41
PIM3 Q86V86 1/20 0.41
HSD11B1 P28845 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 2/20 0.40
USP2 O75604 1/20 0.40
NAMPT P43490 1/20 0.40
NPY2R P49146 1/20 0.39
KMT2A Q03164 1/20 0.38
EPHX2 P34913 1/20 0.38
LMNA P02545 1/20 0.38
PARP1 P09874 1/20 0.38
PDGFRB P09619 1/20 0.38

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
SCHEMBL4489125 1.00 PIM1 (0.46) PIM1PIM2NPC1RAB9ASMN1; SMN2
SCHEMBL227782 0.92 PIM1 (0.45) PIM1PIM2NPC1RAB9ASMN1; SMN2
SCHEMBL227781 0.92 PIM1 (0.45) PIM1PIM2NPC1RAB9ASMN1; SMN2
SCHEMBL4491108 0.92 PIM1 (0.45) PIM1PIM2SMN1; SMN2ALDH1A1FLT3
SCHEMBL4491113 0.92 PIM1 (0.45) PIM1PIM2SMN1; SMN2ALDH1A1FLT3
SCHEMBL226764 0.91 EPHX2 (0.46) PIM1PIM2GAANAMPTEPHX2
SCHEMBL226763 0.91 EPHX2 (0.46) PIM1PIM2GAANAMPTEPHX2
SCHEMBL4504619 0.89 PIM1 (0.47) PIM1PIM2FLT3PIM3POLB
SCHEMBL4504622 0.89 PIM1 (0.47) PIM1PIM2FLT3PIM3POLB
SCHEMBL4505327 0.87 AAK1 (0.44) PIM1PIM2SMN1; SMN2ALDH1A1PDGFRB

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
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
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 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 (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 1326/4885NPC1 3787/4885

“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.