SCHEMBL4494487

SCHEMBL4494487

CN(C)CCCN(c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccc(CC(=O)O)cc2)cc1)S(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 12/20 0.36
CPT1B Q92523 12/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 3/20 0.35
TOP2B Q02880 1/20 0.34
MAPT P10636 1/20 0.34
NPC1 O15118 1/20 0.34
GALR3 O60755 1/20 0.34
RAB9A P51151 1/20 0.34
CPT2 P23786 2/20 0.33
PLK1 P53350 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
SCHEMBL4497689 1.00 CPT1A (0.36) CPT1ACPT1BSMN1; SMN2MEN1LMNA
SCHEMBL4494978 0.95 CPT1A (0.35) CPT1ACPT1BSMN1; SMN2MEN1LMNA
SCHEMBL4494982 0.95 CPT1A (0.35) CPT1ACPT1BSMN1; SMN2MEN1LMNA
SCHEMBL228903 0.93 KDM4E (0.36) CPT1ACPT1BSMN1; SMN2MEN1LMNA
SCHEMBL228902 0.93 KDM4E (0.36) CPT1ACPT1BSMN1; SMN2MEN1LMNA
SCHEMBL4493681 0.92 PLK1 (0.36) SMN1; SMN2MEN1LMNAKMT2AKDM4E
SCHEMBL4493686 0.92 PLK1 (0.36) SMN1; SMN2MEN1LMNAKMT2AKDM4E
SCHEMBL4494601 0.91 BACE1 (0.36) SMN1; SMN2MEN1LMNAKMT2AKDM4E
SCHEMBL4494605 0.91 BACE1 (0.36) SMN1; SMN2MEN1LMNAKMT2AKDM4E
SCHEMBL4491940 0.91 GAA (0.36) SMN1; SMN2MEN1LMNAKMT2AKDM4E

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-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US claimed
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 CPT1A 1291/4885CPT1B 2676/4885SMN1; SMN2 4006/4885

“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.