SCHEMBL11262967

SCHEMBL11262967

CN(C)CCOC1(Cc2ccc(Cl)cc2)CC2CCC1(C)C2(C)C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 1/20 0.53
SLC6A12 P48065 1/20 0.53
SLC6A11 P48066 1/20 0.53
AQP3 Q92482 1/20 0.40
AQP1 P29972 1/20 0.39
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CXCR3 P49682 3/20 0.34
LMNA P02545 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GAA P10253 1/20 0.32
P2RX7 Q99572 1/20 0.31
FPR3 P25089 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
APP P05067 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 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
SCHEMBL11251560 0.93 SLC6A1 (0.46) SLC6A1SLC6A12SLC6A11AQP3AQP1
Ramciclane SCHEMBL2108206 0.88 SLC6A1 (0.64) SLC6A1SLC6A12SLC6A11AQP3AQP1
SCHEMBL11257896 0.82 SLC6A1 (0.56) SLC6A1SLC6A12SLC6A11AQP3AQP1
SCHEMBL7780678 0.82 SLC6A1 (0.56) SLC6A1SLC6A12SLC6A11AQP3AQP1
SCHEMBL11241358 0.77 SLC6A1 (0.50) SLC6A1SLC6A12SLC6A11TSHRLMNA
SCHEMBL11252330 0.76 SLC6A1 (0.49) SLC6A1SLC6A12SLC6A11L3MBTL1GAA
SCHEMBL11253836 0.73 SLC6A1 (0.45) SLC6A1SLC6A12SLC6A11
SCHEMBL11245908 0.72 SLC6A1 (0.45) SLC6A1SLC6A12SLC6A11
SCHEMBL11248768 0.71 LMNA (0.40) SLC6A1SLC6A12SLC6A11CXCR3LMNA
SCHEMBL7779560 0.71 SLC6A1 (0.46) SLC6A1SLC6A12SLC6A11

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
US-11478467-B2 Targeted drug rescue with novel compositions, combinations, and methods thereof Exciva GmbH (DE) 2022-10-25 US claimed
US-20200069674-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF Exciva GmbH (DE) 2020-03-05 US claimed
US-11478467-B2 Targeted drug rescue with novel compositions, combinations, and methods thereof Exciva GmbH (DE) 2022-10-25 US disclosed
US-20200261442-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF VEPACHEDU SREENIVASARAO (US) 2020-08-20 US disclosed
US-4342762-A USEFUL AS TRANQUILIZERS, ANALGESICS, ANTIEPILEPTIC AGENTS, AND AS A TREATMENT FOR PARKINSON'S DISEASE EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-08-03 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 (3 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-11478467-B2 Targeted drug rescue with novel compositions, combinations, and methods thereof HTR2A, HTR2C, CYP3A43 SLC6A1 507/4885SLC6A12 1460/4885SLC6A11 718/4885
US-20200069674-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF HTR2A, HTR2C, CYP3A43 SLC6A1 507/4885SLC6A12 1460/4885SLC6A11 718/4885
US-20200261442-A1 TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF HTR2C, HTR2A, HTR3A SLC6A1 293/4885SLC6A12 1255/4885SLC6A11 395/4885

“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.