SCHEMBL19956391

SCHEMBL19956391

C=Cc1ccc(N(CC)CC)cc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 16/20 0.60
▸ ALDH1A1 P00352 15/20 0.60
▸ KDM4E B2RXH2 10/20 0.60
▸ MEN1 O00255 6/20 0.60
▸ LMNA P02545 6/20 0.60
▸ KMT2A Q03164 6/20 0.60
▸ TDP1 Q9NUW8 3/20 0.60
▸ CRHBP P24387 1/20 0.60
▸ CRHR2 Q13324 1/20 0.60
▸ GAA P10253 8/20 0.57
▸ SMN1; SMN2 Q16637 6/20 0.57
▸ HTT P42858 4/20 0.57
▸ BLM P54132 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ HPGD P15428 5/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ ALOX12 P18054 1/20 0.54

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
SCHEMBL14354290 0.82 MAPT (0.60) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL56902 0.82 ALDH1A1 (0.61) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL29397257 0.82 ALDH1A1 (0.61) MAPTALDH1A1KDM4EMEN1LMNA
Ammonia Solution, Strong SCHEMBL28913421 0.81 ALDH1A1 (0.59) MAPTALDH1A1KDM4EMEN1LMNA
Charcoal, Activated SCHEMBL31112505 0.81 ALDH1A1 (0.59) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL1072303 0.80 S100B (0.55) MAPTALDH1A1KDM4EMEN1LMNA
Acrylic Acid SCHEMBL28390613 0.80 MAPT (0.52) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL23498169 0.79 MAPT (0.70) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL8409320 0.79 ALDH1A1 (0.49) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL2316177 0.78 MAPT (0.69) MAPTALDH1A1KDM4EMEN1LMNA

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
EP-2150586-B1 DYES HAVING RATIOMETRIC FLUORESCENCE RESPONSE FOR DETECTING METABOLITES BECTON DICKINSON CO (US) 2018-03-14 — — EP disclosed
Send feedback