SCHEMBL6693464

SCHEMBL6693464

CCCNC(=O)C1=Cc2ccccc2Oc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
GPR84 Q9NQS5 1/20 0.40
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
MAOB P27338 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL4043208 0.75 LMNA (0.70) LMNAGPR84KMT2ACA12CA9
SCHEMBL4038858 0.75 LMNA (0.54) LMNAGPR84KMT2AMAPTCA12
Hydrochloric Acid SCHEMBL4045240 0.73 LMNA (0.68) LMNAGPR84KMT2ACA12CA9
SCHEMBL4213975 0.73 LMNA (0.52) LMNAGPR84KMT2AMAPTCA12
SCHEMBL11741524 0.71 PDK2 (0.43) LMNAKMT2ACA9KDM4EHPGD
SCHEMBL14321593 0.71 TP53 (0.58) KMT2AMAPTKDM4EHPGDNPC1
SCHEMBL5953124 0.70 DRD2 (0.40) LMNAGPR84KMT2AMAPTCA12
Hydrochloric Acid SCHEMBL9056904 0.69 DRD2 (0.40) LMNAGPR84KMT2AMAPTCA12
SCHEMBL6689958 0.68 LMNA (0.44) LMNAGPR84CA12CA9DRD2
SCHEMBL5953253 0.66 KMT2A (0.40) GPR84KMT2AMAPTKDM4EHPGD

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-2004039773-A2 COUMPOUNDS MODULATING THE ACTIVITY OF GAPDH AND/OR IAMT NORDIC BIOSCIENCE A/S (DK) 2004-05-13 WO disclosed