SCHEMBL11199895

SCHEMBL11199895

CCc1[nH]c(=O)ccc1-c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.49
PDE10A Q9Y233 2/20 0.44
LMNA P02545 1/20 0.44
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
TGFBR1 P36897 1/20 0.43
KDM4E B2RXH2 3/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
PKM P14618 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ABL1 P00519 1/20 0.41
ABCB1 P08183 1/20 0.41
BCR P11274 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
GSTP1 P09211 1/20 0.40

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
SCHEMBL5904146 0.78 PDE10A (0.60) MAP2K1PDE10ALMNAPDE3BPDE3A
SCHEMBL11086702 0.78 MAP2K1 (0.53) MAP2K1PDE10ALMNAPDE3BPDE3A
SCHEMBL10994404 0.76 PARP1 (0.45) PDE10APDE3BPDE3ATGFBR1KDM4E
SCHEMBL10889141 0.73 PDE3B (0.68) PDE10ALMNAPDE3BPDE3AKDM4E
SCHEMBL10999103 0.72 SMN1; SMN2 (0.45) PDE10AKDM4EMAPTALDH1A1SMN1; SMN2
SCHEMBL25904292 0.71 PDE3B (0.57) MAP2K1LMNAPDE3BPDE3AKDM4E
SCHEMBL22721784 0.70 GSTP1 (0.70) KDM4EMAPTTHRBPKMTDP1
SCHEMBL9705393 0.70 NOTUM (0.45) MAP2K1PDE10ATGFBR1KDM4EMAPT
SCHEMBL25903697 0.70 PDE3B (0.56) MAP2K1LMNAPDE3BPDE3AKDM4E
SCHEMBL17980649 0.69 MAP2K1 (0.54) MAP2K1PDE10ALMNAPDE3BPDE3A

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-0074091-A2 2(1H)-pyridinones and preparation thereof STERLING DRUG INC. (US) 1983-03-16 EP disclosed