SCHEMBL10714848

SCHEMBL10714848

O=C1C2=CCCCC2C(=O)N1OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MAPT P10636 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ KCNA5 P22460 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33
▸ PSENEN Q9NZ42 1/20 0.33
▸ MAOA P21397 1/20 0.33

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
SCHEMBL13479775 0.71 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL3716744 0.68 ALDH1A1 (0.54) ALDH1A1MEN1KMT2ACYP3A4GAA
SCHEMBL10476940 0.66 LMNA (0.33) ALDH1A1MAPTTSHRLMNA
SCHEMBL16577066 0.66 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AMAPTKDM4C
SCHEMBL29367470 0.65 KMT2A (0.74) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL6524461 0.65 KMT2A (0.74) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL1929687 0.65 ALOX12 (0.54) ALDH1A1MEN1KMT2AMAPTALOX15
SCHEMBL20997478 0.65 ALOX12 (0.54) ALDH1A1MEN1KMT2AMAPTALOX15
SCHEMBL24379310 0.64 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14124969 0.64 ALDH1A1 (0.42) ALDH1A1MEN1KMT2AMAPTKDM4C

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
WO-1987007602-A2 N-(5-SUBSTITUTED METHYLENE) PHENYL HERBICIDES RHONE-POULENC AGROCHIMIE (FR) 1987-12-17 — — WO disclosed
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