SCHEMBL4935364

SCHEMBL4935364

C=CCN(CC=C)C(=O)Nc1cc(C)ccc1OC

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.77
▸ ALDH1A1 P00352 3/20 0.75
▸ TDP1 Q9NUW8 3/20 0.54
▸ TP53 P04637 2/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ TSHR P16473 1/20 0.51
▸ MEN1 O00255 5/20 0.50
▸ KMT2A Q03164 5/20 0.50
▸ MAPT P10636 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ CASP3 P42574 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL4939290 0.83 NPSR1 (0.53) NPSR1ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL4936202 0.82 NPSR1 (0.70) NPSR1ALDH1A1TDP1SMN1; SMN2MEN1
SCHEMBL13607121 0.81 NPSR1 (0.74) NPSR1ALDH1A1TDP1TP53SMN1; SMN2
SCHEMBL4937220 0.81 KMT2A (0.55) NPSR1ALDH1A1TP53SMN1; SMN2MEN1
SCHEMBL11137902 0.78 KMT2A (0.61) NPSR1ALDH1A1TP53TSHRMEN1
SCHEMBL6464089 0.75 KMT2A (0.61) ALDH1A1TDP1TP53SMN1; SMN2TSHR
SCHEMBL11660382 0.75 HPGD (0.70) ALDH1A1TDP1TP53SMN1; SMN2TSHR
SCHEMBL862532 0.75 TSHR (0.70) ALDH1A1TDP1TP53SMN1; SMN2TSHR
SCHEMBL6579496 0.74 SMN1; SMN2 (0.66) ALDH1A1TDP1TP53SMN1; SMN2TSHR
SCHEMBL29451289 0.74 SMN1; SMN2 (0.66) ALDH1A1TDP1TP53SMN1; SMN2TSHR

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
US-20080308492-A1 Filter Medium for Technical Applications, and Method for the Production Thereof MAHLE INTERNATIONAL GMBH (DE) 2008-12-18 — — US claimed
US-20080308492-A1 Filter Medium for Technical Applications, and Method for the Production Thereof MAHLE INTERNATIONAL GMBH (DE) 2008-12-18 — — US disclosed
Send feedback