SCHEMBL6125624

SCHEMBL6125624

COc1ccc(-c2cccc3nnc(-c4ccc(OC)cc4)n23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 1/20 0.52
▸ JAK1 P23458 3/20 0.50
▸ MAPT P10636 4/20 0.46
▸ LMNA P02545 3/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPK14 Q16539 2/20 0.44
▸ JAK2 O60674 2/20 0.44
▸ DAPK3 O43293 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ NTRK1 P04629 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ CSF1R P07333 1/20 0.44
▸ RET P07949 1/20 0.44
▸ MET P08581 1/20 0.44
▸ PDGFRB P09619 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
SCHEMBL16303628 0.72 KDR (0.64) JAK1MAPTMEN1KMT2ATSHR
SCHEMBL22494221 0.70 RAB9A (0.62) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL24185627 0.69 NPC1 (0.47) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL15698733 0.69 CDK8 (0.66) EGLN2JAK1MEN1KMT2AALDH1A1
SCHEMBL11377976 0.68 SMN1; SMN2 (0.47) EGLN2MEN1KMT2AMAPK14JAK2
SCHEMBL13579637 0.68 KDR (0.49) JAK1MAPTLMNAMEN1KMT2A
SCHEMBL6118992 0.68 SCN5A (0.64) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL6118164 0.67 SCN5A (0.58) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL3090231 0.67 JAK1 (1.00) EGLN2JAK1MEN1KMT2AALDH1A1
SCHEMBL1422714 0.67 JAK1 (0.70) EGLN2JAK1LMNAMEN1KMT2A

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
WO-2012065297-A1 3-ARYL-6-ARYL-[1,2,4]TRIAZOLO[4,3-a]PYRIDINES AS INHIBITORS OF CELL PROLIFERATION AND THE USE THEREOF IMPACT THERAPEUTICS, INC. (CN) 2012-05-24 — — WO claimed
WO-2012065297-A1 3-ARYL-6-ARYL-[1,2,4]TRIAZOLO[4,3-a]PYRIDINES AS INHIBITORS OF CELL PROLIFERATION AND THE USE THEREOF IMPACT THERAPEUTICS, INC. (CN) 2012-05-24 — — WO disclosed
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