SCHEMBL10595200

SCHEMBL10595200

COc1ccccc1CN/C=C1/N=C(c2ccccc2)OC1=O

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TNNI3 P19429 1/20 0.51
CRHBP P24387 1/20 0.51
TNNT2 P45379 1/20 0.51
TNNC1 P63316 1/20 0.51
CRHR2 Q13324 1/20 0.51
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
F2 P00734 2/20 0.41
MASP2 O00187 2/20 0.41
HPGD P15428 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DAPK3 O43293 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
SCHEMBL10595203 1.00 MEN1 (0.51) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL10757419 0.81 MEN1 (0.54) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL10757426 0.81 MEN1 (0.54) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL6793562 0.75 KMT2A (0.75) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL6793560 0.75 KMT2A (0.75) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL5516544 0.73 SMN1; SMN2 (0.51) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL5516539 0.73 SMN1; SMN2 (0.51) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL350875 0.71 ALDH1A1 (0.58) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL6796295 0.71 KMT2A (0.65) MEN1KMT2ATNNI3CRHBPTNNT2
SCHEMBL6796298 0.71 KMT2A (0.65) MEN1KMT2ATNNI3CRHBPTNNT2

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
JP-1029369-A None JP disclosed