SCHEMBL9047342

SCHEMBL9047342

Oc1c2ccnc-2ncn1C#Cc1ccc(Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
P2RX7 Q99572 1/20 0.30

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
SCHEMBL9046222 0.86 MEN1 (0.33) MEN1KMT2A
SCHEMBL9047422 0.86 MEN1 (0.33) MEN1KMT2A
SCHEMBL9047563 0.86 GRM5 (0.33)
SCHEMBL9471259 0.79 KMT2A (0.37) MEN1KMT2A
SCHEMBL9046427 0.71 ADORA1 (0.38) MEN1MAPTKMT2A
SCHEMBL9045912 0.68 PSMB2 (0.38) MEN1MAPTKMT2AP2RX7
SCHEMBL9471499 0.66 KDM4E (0.37) MEN1MAPTKMT2A
SCHEMBL9480388 0.65 KMT2A (0.37) MEN1MAPTKMT2A
SCHEMBL9046478 0.63
SCHEMBL990765 0.59 LMNA (0.44) MAPT

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 6 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
CN-1030608-C N-(pyrrolo {2,3-d} pyrimidin-3-ylacyl)-glutamic acid derivatives UNIV PRINCETON (US) 1996-01-03 CN 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
US-5248775-A Pyrrolo(2,3-d)pyrimidines THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1993-09-28 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
US-4996206-A Antitumor agent THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1991-02-26 US disclosed