SCHEMBL29316294

SCHEMBL29316294

c1cc2c(c(-c3cc[nH]c3)c1)CCN2

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.41
PARP11 Q9NR21 3/20 0.41
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
NOTUM Q6P988 1/20 0.36
PARP1 P09874 7/20 0.36
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
PRCP P42785 1/20 0.32
KDM1A O60341 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL20539302 0.80 NOTUM (0.47) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL30916119 0.80 NOTUM (0.47) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL29648250 0.79 PARP10 (0.64) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL4718535 0.79 PARP10 (0.64) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL31121854 0.76 PARP10 (0.47) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL15312190 0.76 PARP10 (0.47) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL5871204 0.75 PARP10 (0.46) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL10925152 0.73 PARP10 (0.42) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL23055229 0.72 PARP10 (0.41) PARP10PARP11S1PR1S1PR3NOTUM
SCHEMBL10921073 0.72 PARP10 (0.48) PARP10PARP11NOTUM

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-4400558-A1 PHOTON UPCONVERSION COMPOSITION, FILM, MYOPIA-SUPPRESSING TRANSPARENT PRODUCT, AND METHOD FOR CONVERTING VISIBLE LIGHT INTO ULTRAVIOLET LIGHT Kyushu University, National University Corporation (JP) 2024-07-17 EP disclosed