SCHEMBL13199865

SCHEMBL13199865

CC(C)C1CCCNCCC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
CXCR4 P61073 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CPN1 P15169 1/20 0.34
CPB2 Q96IY4 1/20 0.34
SLC6A1 P30531 2/20 0.30
SLC6A11 P48066 1/20 0.30
TSHR P16473 1/20 0.30
LMNA P02545 1/20 0.30
SLC6A13 Q9NSD5 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
SCHEMBL25151798 0.95 SLC6A2 (0.35) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL20118762 0.95 ALDH1A1 (0.38) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL27289508 0.95 SLC6A2 (0.35) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL12309036 0.95 SLC6A2 (0.35) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL18595685 0.93 ALDH1A1 (0.43) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL21707956 0.92 ALDH1A1 (0.40) SMN1; SMN2CXCR4ALDH1A1TSHRLMNA
SCHEMBL13451823 0.87 ALDH1A1 (0.36) SMN1; SMN2CXCR4ALDH1A1CPN1CPB2
SCHEMBL18595691 0.85 ALDH1A1 (0.41) ALDH1A1CPN1CPB2TSHRLMNA
SCHEMBL19139659 0.85 ALDH1A1 (0.41) ALDH1A1CPN1CPB2TSHRLMNA
SCHEMBL806895 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023240024-A1 SULFAMIDE DERIVATIVES AS CYCLIN-DEPENDENT KINASE 2 INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2023-12-14 WO disclosed
WO-2023173083-A1 TETRAHYDROINDOLE DERIVATIVES AS EGFR AND/OR HER2 INHIBTORS USEFUL FOR THE TREATMENT OF CANCER SCORPION THERAPEUTICS, INC. (US) 2023-09-14 WO disclosed
EP-3894402-B1 N-CONTAINING CHROMEN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2023-07-05 EP disclosed
WO-2020120528-A1 N-CONTAINING CHROMEN-4-ONE DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2020-06-18 WO disclosed
US-7772226-B2 Condensed imidazole derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-01-15 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-20090018331-A1 CONDENSED IMIDAZOLE DERIVATIVES DPP4, HDAC1, DPP7 SMN1; SMN2 3923/4885CXCR4 178/4885ALDH1A1 686/4885

“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.