SCHEMBL4486126

SCHEMBL4486126

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
OPRM1 P35372 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
SLC2A1 P11166 1/20 0.33
POLB P06746 1/20 0.33
KDR P35968 1/20 0.33
PRKAA2 P54646 1/20 0.33
PRKAA1 Q13131 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LRRK2 Q5S007 1/20 0.33
EGFR P00533 1/20 0.32
PRMT1 Q99873 1/20 0.32
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL4486118 1.00 CNR1 (0.35) CNR1SMN1; SMN2NPC1RAB9AOPRM1
SCHEMBL4485064 0.92 CNR1 (0.36) CNR1SMN1; SMN2NPC1RAB9ASIGMAR1
SCHEMBL4485071 0.92 CNR1 (0.36) CNR1SMN1; SMN2NPC1RAB9ASIGMAR1
SCHEMBL4497172 0.91 BACE1 (0.38) SMN1; SMN2OPRM1SIGMAR1KDRPRKAA2
SCHEMBL4497166 0.91 BACE1 (0.38) SMN1; SMN2OPRM1SIGMAR1KDRPRKAA2
SCHEMBL4496690 0.87 LIMK1 (0.36) SMN1; SMN2KDM4EALDH1A1LRRK2MEN1
SCHEMBL4496696 0.87 LIMK1 (0.36) SMN1; SMN2KDM4EALDH1A1LRRK2MEN1
SCHEMBL4486121 0.87 TMEM97 (0.43) SIGMAR1ACHE
SCHEMBL4503999 0.85 CNR1 (0.36) CNR1SMN1; SMN2NPC1RAB9ASLC2A1
SCHEMBL4498773 0.83 CNR1 (0.37) CNR1SMN1; SMN2NPC1RAB9ASLC2A1

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 487/4885SMN1; SMN2 4006/4885NPC1 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.