SCHEMBL7092495

SCHEMBL7092495

COc1ccc(C2CC2N)cc1C

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 9/20 0.68
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
DPP4 P27487 3/20 0.51
TUBB4A P04350 5/20 0.50
TUBB P07437 5/20 0.50
TUBA3C P0DPH7 5/20 0.50
TUBA1B P68363 5/20 0.50
TUBA4A P68366 5/20 0.50
TUBB4B P68371 5/20 0.50
TUBB3 Q13509 5/20 0.50
TUBB2A Q13885 5/20 0.50
TUBB8 Q3ZCM7 5/20 0.50
TUBA3E Q6PEY2 5/20 0.50
TUBA1A Q71U36 5/20 0.50
TUBA1C Q9BQE3 5/20 0.50
TUBB6 Q9BUF5 5/20 0.50
TUBB2B Q9BVA1 5/20 0.50
TUBB1 Q9H4B7 5/20 0.50

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
SCHEMBL7002844 1.00 KDM1A (0.68) KDM1AMAOAMAOBDPP4TUBB4A
SCHEMBL7002848 1.00 KDM1A (0.68) KDM1AMAOAMAOBDPP4TUBB4A
SCHEMBL7094483 0.86 KDM1A (0.63) KDM1AMAOAMAOBDPP4TUBB4A
SCHEMBL7868679 0.86 KDM1A (0.63) KDM1AMAOAMAOBDPP4TUBB4A
SCHEMBL7094484 0.86 KDM1A (0.63) KDM1AMAOAMAOBDPP4TUBB4A
SCHEMBL7092215 0.85 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL6996727 0.85 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL6996729 0.85 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL7092159 0.81 KDM1A (0.66) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL7002459 0.81 KDM1A (0.66) KDM1AMAOAMAOBTUBB4ATUBB

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
EP-0996621-B1 TRIAZOLO[4,5-d]PYRIMIDINE DERIVATIVES AS ANTI-THROMBOTIC AGENTS ASTRAZENECA AB (SE) 2003-10-01 EP disclosed