SCHEMBL4773397

SCHEMBL4773397

Ic1ccc2n[nH]cc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.39
TYMS P04818 2/20 0.37
PARP1 P09874 1/20 0.35
APP P05067 6/20 0.34
MAPT P10636 1/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31
TUBB6 Q9BUF5 1/20 0.31
TUBB2B Q9BVA1 1/20 0.31
TUBB1 Q9H4B7 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
SCHEMBL17696315 0.83 TYMS (0.37) NOS1TYMSPARP1APP
SCHEMBL12653740 0.76 CYP1A2 (0.48) MAPT
SCHEMBL13415 0.74 BACE1 (0.44) NOS1TYMSMAPT
SCHEMBL19359062 0.74 ALDH1A1 (0.48) PARP1
SCHEMBL16523221 0.74 F7 (0.48) NOS1MAPT
SCHEMBL16523329 0.74 BACE1 (0.44) TYMSPARP1MAPT
SCHEMBL28207942 0.71 ALDH1A1 (0.34)
SCHEMBL18003378 0.71 KDM4E (0.50)
SCHEMBL25422558 0.69 ALDH1A1 (0.37) MAPT
SCHEMBL17130561 0.69 KMT2A (0.46) TYMSMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146991-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
WO-2014078813-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES IRM LLC (BM) 2014-05-22 WO disclosed
EP-2001480-A2 INDAZOLE COMPOUNDS Abbott Laboratories (US) 2008-12-17 EP disclosed
WO-2007117465-A2 INDAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2007-10-18 WO disclosed