SCHEMBL29138716

SCHEMBL29138716

COc1ccc(OC)c(C(=O)NN)c1.NNC(=O)c1c(F)cccc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.53
CTSD P07339 1/20 0.51
NPC1 O15118 2/20 0.48
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
GAA P10253 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
POLB P06746 2/20 0.46
PTPN7 P35236 1/20 0.46
DUSP3 P51452 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPK1 P28482 1/20 0.45
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.44

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
SCHEMBL6478100 0.86 CTSD (0.62) CTSDKCNK3KCNK9GAASMN1; SMN2
SCHEMBL25213585 0.79 CA1 (0.54) RAB9ACTSDNPC1GAASMN1; SMN2
SCHEMBL1691639 0.79 CPS1 (0.56) RAB9ACTSDNPC1GAASMN1; SMN2
SCHEMBL4342983 0.76 CTSD (0.65) RAB9ACTSDNPC1GAASMN1; SMN2
SCHEMBL4245850 0.76 RAB9A (0.59) RAB9ACTSDNPC1KCNK3KCNK9
SCHEMBL1127907 0.75 CES2 (0.56) RAB9ANPC1GAAMAPTHTT
SCHEMBL4939202 0.74 TP53 (0.66) RAB9ACTSDNPC1GAASMN1; SMN2
SCHEMBL10557566 0.74 CA1 (0.59) RAB9ACTSDNPC1GAASMN1; SMN2
SCHEMBL29970839 0.74 CES2 (0.56) RAB9ACTSDNPC1GAAMAPT
SCHEMBL16151876 0.73 ALDH1A1 (0.62) CTSDGAASMN1; SMN2MAPTHTT

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-116887609-A Perovskite thin film layer and preparation method thereof, perovskite silicon laminated solar cell and preparation method thereof 通威太阳能(成都)有限公司 2023-10-13 CN claimed
CN-116887609-A Perovskite thin film layer and preparation method thereof, perovskite silicon laminated solar cell and preparation method thereof 通威太阳能(成都)有限公司 2023-10-13 CN disclosed