SCHEMBL5658455

SCHEMBL5658455

CCOC(=O)C1=C(N)C(C)CCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.41
MAPT P10636 8/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 6/20 0.41
ALOX15 P16050 4/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 5/20 0.41
HPGD P15428 5/20 0.41
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 2/20 0.39
CXCR2 P25025 1/20 0.39
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 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
SCHEMBL21950883 0.87 KDM4E (0.43) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL28611288 0.76 ALDH1A1 (0.38) ALDH1A1MAPTSMN1; SMN2KDM4EALOX15
SCHEMBL12323920 0.75 KDM4E (0.49) ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL680908 0.75 KDM4E (0.49) ALDH1A1MAPTSMN1; SMN2RAB9AKDM4E
SCHEMBL28283233 0.74 KDM4E (0.55) ALDH1A1MAPTSMN1; SMN2NPC1KDM4E
SCHEMBL234027 0.74 KDM4E (0.55) ALDH1A1MAPTSMN1; SMN2KDM4EALOX15
SCHEMBL1144592 0.74 ALDH1A1 (0.47) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL3456275 0.74 MAPT (0.47) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL14079850 0.73 ALDH1A1 (0.46) ALDH1A1MAPTSMN1; SMN2KDM4EALOX15
Hydrochloric Acid SCHEMBL7360757 0.73 MAPT (0.46) ALDH1A1MAPTSMN1; SMN2NPC1RAB9A

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-7157475-B2 Diamide invertebrate pest control agents E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-01-02 US disclosed
US-20040259913-A1 Diamide invertebrate pest control agents E. I. DU PONT NEMOURS AND COMPANY 2004-12-23 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-20040259913-A1 Diamide invertebrate pest control agents DDT, DBF4, CBR1 ALDH1A1 1119/4885MAPT 3325/4885SMN1; SMN2 980/4885

“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.