SCHEMBL10548438

SCHEMBL10548438

CCC(N)Oc1cccc(Oc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.47
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
PTGS1 P23219 1/20 0.45
HTR1D P28221 1/20 0.44
HTR1B P28222 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MEN1 O00255 1/20 0.44
MITF O75030 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
GFER P55789 1/20 0.44
KMT2A Q03164 1/20 0.44
NLRP1 Q9C000 1/20 0.44
NOD2 Q9HC29 1/20 0.44
AKR1C3 P42330 1/20 0.43
LTA4H P09960 2/20 0.43
LMNA P02545 1/20 0.43
ALOX5 P09917 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL1033247 0.83 SLC6A4 (0.43) ALDH1A1PTGS1LTA4HLMNATSHR
SCHEMBL10552651 0.83 RXRA (0.46) MAOBMAPT
SCHEMBL10556469 0.82 TAAR1 (0.51) ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL9325840 0.82 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2MEN1GAA
SCHEMBL9326252 0.81 TP53 (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTLTA4H
SCHEMBL9324031 0.79 ACHE (0.48) ALDH1A1SMN1; SMN2GAAKMT2ALTA4H
SCHEMBL9324036 0.78 KIF11 (0.34) ALDH1A1KDM4EMEN1KMT2ATSHR
SCHEMBL9324046 0.77 KDM4E (0.45) MAOBALDH1A1KDM4ESMN1; SMN2GAA
SCHEMBL10549386 0.77 OGG1 (0.50) ALDH1A1KDM4EMAPTKMT2A
SCHEMBL9325097 0.77 SLC6A4 (0.49) MAOBMEN1KMT2A

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-4844731-A HERBICIDES FOR RICE PADDYS IDEMITSU COMPANY CO., LTD. (JP) 1989-07-04 US disclosed