SCHEMBL9045924

SCHEMBL9045924

Cc1nc2ncn(C#Cc3ccc(F)cc3)c(O)c-2c1OC(=O)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
EGLN1 Q9GZT9 1/20 0.31
EGLN3 Q9H6Z9 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL9046699 0.92 USP2 (0.34) MAPTKMT2A
SCHEMBL9046580 0.90 ELANE (0.36)
SCHEMBL9044791 0.90 L3MBTL1 (0.33) MAPTKMT2A
SCHEMBL9045074 0.90 ELANE (0.33) MAPT
SCHEMBL9046356 0.89 PTPN11 (0.33) MAPTKMT2A
SCHEMBL9775992 0.84 NPC1 (0.37) EGLN1EGLN3GRM5
SCHEMBL9045154 0.77 MAPT (0.33) MAPTKMT2A
SCHEMBL9775978 0.76 USP2 (0.31)
SCHEMBL9776044 0.76 MAPT (0.38) MAPTKMT2A
SCHEMBL9776108 0.74 TDP1 (0.37) KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0432677-B1 N-(pyrrolo[2,3-d]pyrimidin-3-ylacyl)-glutamic acid derivatives UNIV PRINCETON (US) 1996-03-06 EP disclosed
US-5344932-A N-(pyrrolo(2,3-d)pyrimidin-3-ylacyl)-glutamic acid derivatives TRUSTEES OF PRINCETON UNIVERSITY (US) 1994-09-06 US disclosed
EP-0432677-A1 N-(pyrrolo[2,3-d]pyrimidin-3-ylacyl)-glutamic acid derivatives THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1991-06-19 EP disclosed