SCHEMBL9252885

SCHEMBL9252885

CCCCCCCCCCc1ccc2nc3c(c(Cl)c2c1)CCCC3

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
ACHE P22303 12/20 0.51
BCHE P06276 7/20 0.49
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL9256559 1.00 MAPT (0.56) MAPTACHEBCHEALDH1A1POLB
Hydrochloric Acid SCHEMBL9256019 0.99 MAPT (0.55) MAPTACHEBCHE
SCHEMBL9255203 0.90 ACHE (0.56) MAPTACHEALDH1A1
SCHEMBL9260059 0.88 ACHE (0.60) ACHEBCHE
SCHEMBL9255981 0.88 ACHE (0.60) ACHEBCHE
SCHEMBL9256157 0.88 ACHE (0.60) ACHEBCHE
SCHEMBL9255193 0.88 ACHE (0.60) ACHEBCHE
SCHEMBL9252756 0.85 ACHE (0.51) MAPTACHEBCHEALDH1A1POLB
SCHEMBL10699056 0.83 ACHE (0.60) ACHEBCHE
SCHEMBL9260330 0.81 ACHE (0.74) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5391553-A Increasing cholinergic functionin mammals HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-02-21 US disclosed