SCHEMBL28563303

SCHEMBL28563303

C=C1Cc2ccc(C(=O)Oc3ccccc3)cc2N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PARP10 Q53GL7 1/20 0.43
NSD2 O96028 1/20 0.43
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
RARG P13631 1/20 0.40
ALOX5 P09917 1/20 0.40
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
TMPRSS15 P98073 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
SRD5A1 P18405 1/20 0.38
SRD5A2 P31213 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 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
SCHEMBL27512078 0.77 MAPT (0.48) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL28564302 0.73 MAOA (0.46) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL69953 0.70 MAPT (0.62) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL70034 0.70 PARP10 (0.70) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL10664572 0.69 PARP10 (0.65) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL69684 0.69 NSD2 (0.63) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL31094160 0.69 MAPT (0.43) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL2035745 0.68 NSD2 (0.74) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL72201 0.68 MAPT (0.62) MAPTALDH1A1MEN1KMT2APARP10
SCHEMBL418527 0.68 MAPT (0.68) MAPTALDH1A1MEN1KMT2APARP10

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
CN-109302846-B Indolinone compounds and their use in the treatment of fibrotic diseases 莱斯彼维特有限公司 2021-05-11 CN claimed
CN-109153666-B Indole derivatives and their use as protein kinase inhibitors 莱斯彼维特有限公司 2021-07-16 CN disclosed