SCHEMBL2193586

SCHEMBL2193586

CN[C@H]1CCN(Cc2ccccc2)C[C@@H]1O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.55
ALDH1A1 P00352 1/20 0.54
SLC18A3 Q16572 1/20 0.53
ACHE P22303 5/20 0.51
BCHE P06276 4/20 0.51
BACE1 P56817 4/20 0.51
UBE2M P61081 1/20 0.51
DCUN1D1 Q96GG9 1/20 0.51
CXCR4 P61073 1/20 0.48
GBA1 P04062 1/20 0.48
SCN4A P35499 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL2193590 1.00 FUCA1 (0.55) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL2193594 1.00 FUCA1 (0.55) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL15555624 0.88 ALDH1A1 (0.54) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL9057716 0.86 FUCA1 (0.65) FUCA1ALDH1A1SLC18A3ACHEGBA1
SCHEMBL9055650 0.86 FUCA1 (0.65) FUCA1ALDH1A1SLC18A3ACHEGBA1
SCHEMBL9057711 0.86 FUCA1 (0.65) FUCA1ALDH1A1SLC18A3ACHEGBA1
SCHEMBL2187469 0.86 FUCA1 (0.53) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL2187476 0.86 FUCA1 (0.53) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL2187482 0.86 FUCA1 (0.53) FUCA1ALDH1A1SLC18A3ACHEBCHE
SCHEMBL2189114 0.84 ACHE (0.65) FUCA1ALDH1A1SLC18A3ACHEBCHE

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-2351738-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO)PIPERIDIN-3-OL Sumitomo Chemical Company, Limited (JP) 2011-08-03 EP disclosed
US-20110172431-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO) PIPERIDIN-3-OL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-14 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-20110172431-A1 PROCESS FOR PRODUCING 1-SUBSTITUTED TRANS-4-(SUBSTITUTED AMINO) PIPERIDIN-3-OL TEAD4, TEAD3, TEAD2 FUCA1 2251/4885ALDH1A1 93/4885SLC18A3 1096/4885

“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.