SCHEMBL28620148

SCHEMBL28620148

C(=C1CNc2ccccc21)c1c[nH]c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ MAPT P10636 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ NTRK1 P04629 2/20 0.53
▸ DAPK3 O43293 1/20 0.53
▸ PRKD3 O94806 1/20 0.53
▸ MAP4K4 O95819 1/20 0.53
▸ ABL1 P00519 1/20 0.53
▸ LCK P06239 1/20 0.53
▸ FYN P06241 1/20 0.53
▸ CSF1R P07333 1/20 0.53
▸ RET P07949 1/20 0.53
▸ PDGFRB P09619 1/20 0.53
▸ PDGFRA P16234 1/20 0.53
▸ LTK P29376 1/20 0.53
▸ GRK5 P34947 1/20 0.53

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
SCHEMBL16426792 0.72 IKBKB (0.54) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL16426791 0.72 IKBKB (0.54) KDM4EALDH1A1MAPTLMNAKMT2A
SCHEMBL28129799 0.71 MAOB (0.43) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL8171751 0.71 MAPT (0.61) KDM4EALDH1A1MAPTLMNAMEN1
SCHEMBL14448886 0.70 NTRK1 (1.00) KDM4EALDH1A1MAPTLMNANTRK1
SCHEMBL1980862 0.70 NTRK1 (1.00) KDM4EALDH1A1MAPTLMNANTRK1
SCHEMBL1980864 0.70 NTRK1 (1.00) KDM4EALDH1A1MAPTLMNANTRK1
SCHEMBL5604228 0.69 ALDH1A1 (0.76) KDM4EALDH1A1MAPTLMNAMEN1
SCHEMBL5604224 0.69 ALDH1A1 (0.76) KDM4EALDH1A1MAPTLMNAMEN1
SCHEMBL5605289 0.69 ALDH1A1 (0.76) KDM4EALDH1A1MAPTLMNAMEN1

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
CN-113286608-A Chimeric Antigen Receptor (CAR) groups 圣安娜儿童癌症研究中心 2021-08-20 — — CN disclosed
Send feedback