SCHEMBL4485071

SCHEMBL4485071

CC(=O)N(CCNCCc1ccccc1)c1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LRRK2 Q5S007 1/20 0.35
SLC2A1 P11166 1/20 0.34
POLB P06746 1/20 0.34
EGFR P00533 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
PRMT1 Q99873 1/20 0.33
GAA P10253 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL4485064 1.00 CNR1 (0.36) CNR1NPC1RAB9ASMN1; SMN2LRRK2
SCHEMBL4486118 0.92 CNR1 (0.35) CNR1NPC1RAB9ASMN1; SMN2LRRK2
SCHEMBL4486126 0.92 CNR1 (0.35) CNR1NPC1RAB9ASMN1; SMN2LRRK2
SCHEMBL4487244 0.91 BACE1 (0.39) SMN1; SMN2KMT2AMAPT
SCHEMBL4487236 0.91 BACE1 (0.39) SMN1; SMN2KMT2AMAPT
SCHEMBL4560169 0.89 LRRK2 (0.36) SMN1; SMN2LRRK2KMT2AMEN1MAPT
SCHEMBL4560167 0.89 LRRK2 (0.36) SMN1; SMN2LRRK2KMT2AMEN1MAPT
SCHEMBL4504536 0.87 ROCK2 (0.37) NPC1LRRK2POLBIDO1TDO2
SCHEMBL4491548 0.87 LIMK1 (0.37) NPC1LRRK2POLBMAPTIDO1
SCHEMBL4491553 0.87 LIMK1 (0.37) NPC1LRRK2POLBMAPTIDO1

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 CNR1 487/4885NPC1 3787/4885RAB9A 1671/4885

“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.