SCHEMBL11096244

SCHEMBL11096244

Cc1cc(Cl)ccc1OCCCCCCBr

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
TP53 P04637 1/20 0.55
ALOX15 P16050 1/20 0.55
ALDH1A1 P00352 2/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
GAA P10253 1/20 0.51
HTT P42858 1/20 0.49
HPGD P15428 3/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
SCN4A P35499 2/20 0.46
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45

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
SCHEMBL22135588 0.89 KDM4E (0.64) KDM4ETP53ALOX15ALDH1A1MEN1
SCHEMBL14015785 0.85 KDM4E (0.56) KDM4ETP53ALOX15ALDH1A1MEN1
SCHEMBL1283086 0.81 MAPT (0.58) KDM4ETP53ALDH1A1KMT2AHPGD
SCHEMBL8347835 0.81 KDM4E (0.59) KDM4ETP53ALOX15ALDH1A1MEN1
SCHEMBL6648626 0.80 PRSS1 (0.49) ALDH1A1MEN1KMT2AHPGDRAB9A
SCHEMBL25261375 0.79 KDM4E (0.61) KDM4ETP53ALOX15ALDH1A1MEN1
SCHEMBL28556250 0.79 ALDH1A1 (0.54) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL8234481 0.79 KDM4E (0.56) KDM4ETP53ALOX15ALDH1A1MEN1
SCHEMBL23571004 0.78 MRGPRX4 (0.49) KDM4EALDH1A1KMT2ARAB9AMRGPRX4
SCHEMBL9119355 0.78 KDM4E (0.52) KDM4EALDH1A1MEN1KMT2AHTT

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-0103252-A2 Aryloxyalkyl amines, process for their preparation and their use in combating unwanted plant growth BASF Aktiengesellschaft (DE) 1984-03-21 EP disclosed