SCHEMBL10338403

SCHEMBL10338403

O=c1[nH]c2ccc(Nc3ccncc3)cc2o1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.61
PDE3A Q14432 3/20 0.61
SYK P43405 2/20 0.53
NOS1 P29475 1/20 0.49
CREBBP Q92793 1/20 0.44
P2RX3 P56373 1/20 0.43
OGT O15294 1/20 0.42
JAK1 P23458 1/20 0.42
JAK3 P52333 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KMO O15229 1/20 0.40
RAD52 P43351 1/20 0.40
MAPKAPK2 P49137 1/20 0.39
CFTR P13569 1/20 0.39

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
SCHEMBL10359665 0.84 SYK (0.55) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL26463982 0.82 PDE3B (0.65) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10437432 0.78 SYK (0.49) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10437460 0.77 SYK (0.49) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10437441 0.77 SYK (0.46) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10437477 0.77 SYK (0.48) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL8311380 0.76 NOS1 (0.61) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL21925302 0.75 SYK (0.56) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10437451 0.75 SYK (0.50) PDE3BPDE3ASYKNOS1CREBBP
SCHEMBL10338289 0.74 PDE3B (0.57) PDE3BPDE3AKDM4EALDH1A1RAD52

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2059575-A None JP disclosed
JP-H0259575-A BENZOXAZOLONE DERIVATIVE OR SALT THEREOF MITSUBISHI KASEI CORP 1990-02-28 JP disclosed