SCHEMBL6019364

SCHEMBL6019364

C[C@@H]1CN(c2ccccc2)C(=O)[C@H]2[C@@H]1CC[C@@H]2C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 1/20 0.40
G6PD P11413 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
DDB1 Q16531 2/20 0.38
CRBN Q96SW2 2/20 0.38
ALOX5 P09917 3/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL5250696 0.84 HSD17B10 (0.42) ALDH1A1POLBUSP2MAPTHPGD
SCHEMBL6019809 0.84 CYP3A4 (0.43) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL6018772 0.84 HSD17B10 (0.42) ALDH1A1POLBUSP2MAPTHPGD
SCHEMBL6018783 0.73
SCHEMBL13046373 0.70 MEN1 (0.50) ALDH1A1POLBSMN1; SMN2USP2MAPT
SCHEMBL18379593 0.69 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2USP2MAPT
SCHEMBL16474469 0.69 ALDH1A1 (0.54) ALDH1A1POLBSMN1; SMN2USP2MAPT
SCHEMBL6019533 0.69 MAPT (0.33) MAPT
SCHEMBL6019489 0.69
SCHEMBL16474467 0.69 ALDH1A1 (0.54) ALDH1A1POLBSMN1; SMN2USP2MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060228387-A1 Dihydronepetalactams and N-substituted derivatives thereof E. I. DU PONT DE NEMOURS AND COMPANY 2006-10-12 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-20060228387-A1 Dihydronepetalactams and N-substituted derivatives thereof NOTCH4, NRDC, BPHL ALDH1A1 2823/4885POLB 3997/4885SMN1; SMN2 1870/4885

“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.