SCHEMBL2192609

SCHEMBL2192609

COc1ccccc1N[C@H]1CCN(Cc2ccccc2)C[C@@H]1O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.58
BACE1 P56817 4/20 0.58
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SIGMAR1 Q99720 3/20 0.51
BCHE P06276 2/20 0.49
POLB P06746 1/20 0.49
DRD2 P14416 3/20 0.48
DRD4 P21917 3/20 0.48
FUCA1 P04066 2/20 0.48
DRD3 P35462 2/20 0.48
KDM4E B2RXH2 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL2192612 1.00 ACHE (0.58) ACHEBACE1ALDH1A1MEN1KMT2A
SCHEMBL12507354 1.00 ACHE (0.58) ACHEBACE1ALDH1A1MEN1KMT2A
SCHEMBL2192618 1.00 ACHE (0.58) ACHEBACE1ALDH1A1MEN1KMT2A
SCHEMBL2192450 0.84 ALDH1A1 (0.53) ACHEBACE1ALDH1A1BCHEPOLB
SCHEMBL2192462 0.84 ALDH1A1 (0.53) ACHEBACE1ALDH1A1BCHEPOLB
SCHEMBL2192456 0.84 ALDH1A1 (0.53) ACHEBACE1ALDH1A1BCHEPOLB
SCHEMBL27837958 0.81 HTT (0.56) ACHEBACE1ALDH1A1MEN1KMT2A
SCHEMBL8487979 0.80 ACHE (0.69) ACHEBACE1ALDH1A1MEN1KMT2A
SCHEMBL2190729 0.80 FUCA1 (0.58) ACHEBACE1ALDH1A1KMT2ABCHE
SCHEMBL2190734 0.80 FUCA1 (0.58) ACHEBACE1ALDH1A1KMT2ABCHE

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 ACHE 3409/4885BACE1 2080/4885ALDH1A1 93/4885

“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.