SCHEMBL6632040

SCHEMBL6632040

CN1CCC2(CCNCC2)N(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
THPO P40225 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
CRBN Q96SW2 1/20 0.30

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
SCHEMBL31416408 0.82 GRM5 (0.32) CRBN
SCHEMBL6633187 0.74 OPRM1 (0.32) PDE4APDE4BPDE4CPDE4D
SCHEMBL2436684 0.72 ALDH1A1 (0.37) CRBN
Hydrochloric Acid SCHEMBL31283258 0.71 ALDH1A1 (0.36) CRBN
SCHEMBL8903570 0.69 GRM5 (0.41) CYP3A4CYP2D6THPOBLMPMP22
SCHEMBL345569 0.68 LTA4H (0.34) PDE4APDE4BPDE4CPDE4DCRBN
SCHEMBL22914767 0.68 SOS1 (0.31)
SCHEMBL6632998 0.68 AKR1B1 (0.30)
SCHEMBL12630577 0.68 SOS1 (0.46)
Hydrochloric Acid SCHEMBL2637438 0.67 LTA4H (0.33) PDE4APDE4BPDE4CPDE4DCRBN

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
EP-1430898-A1 RECEPTOR ANTAGONIST KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-06-23 EP disclosed
US-20040110826-A1 Receptor Antagonists KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-06-10 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-20040110826-A1 Receptor Antagonists ADRA2C, OPRL1, ADRB1 CYP3A4 1268/4885CYP2D6 400/4885THPO 4427/4885

“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.