SCHEMBL5784653

SCHEMBL5784653

CCOC(=O)C1CCN(CCc2ccc(N)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.56
LTA4H P09960 1/20 0.56
ALDH1A1 P00352 5/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HRH3 Q9Y5N1 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 1/20 0.53
KCNH2 Q12809 2/20 0.53

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
SCHEMBL31583128 0.87 MAPT (0.63) KDM4ELTA4HALDH1A1SMN1; SMN2HRH3
SCHEMBL4232561 0.87 HTR2A (0.64) KDM4ELTA4HALDH1A1SMN1; SMN2
SCHEMBL3156422 0.87 KDM4E (0.73) KDM4EALDH1A1SMN1; SMN2HRH3KMT2A
SCHEMBL1414283 0.87 ALDH1A1 (0.67) KDM4ELTA4HALDH1A1NPC1RAB9A
SCHEMBL27541561 0.86 HTR2A (0.63) KDM4ELTA4HALDH1A1SMN1; SMN2
SCHEMBL1414196 0.86 KDM4E (0.61) KDM4ELTA4HALDH1A1SMN1; SMN2HRH3
SCHEMBL5787227 0.83 KCNJ1 (0.68) ALDH1A1SMN1; SMN2HRH3KMT2AKCNH2
SCHEMBL12156559 0.82 KCNH2 (0.76) LTA4HALDH1A1HRH3NPC1RAB9A
Fumaric Acid SCHEMBL15567023 0.81 LTA4H (0.53) KDM4ELTA4HALDH1A1SMN1; SMN2HRH3
SCHEMBL8491424 0.81 HTR2A (0.57) LTA4HHRH3

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
EP-1212318-B1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA (DE) 2006-01-25 EP disclosed
US-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-01-13 US disclosed
US-6794395-B1 Substituted indolinones, their manufacture and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-09-21 US disclosed
EP-1212318-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS Boehringer Ingelheim Pharma KG (DE) 2002-06-12 EP disclosed
WO-2001016130-A1 SUBSTITUTED INDOLINONES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-03-08 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-20050009898-A1 New substituted indolinones, their manufacture and their use as medicaments CCNE1, CDK1, CCNI KDM4E 221/4885LTA4H 3246/4885ALDH1A1 1840/4885

“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.