SCHEMBL7092159

SCHEMBL7092159

COc1ccc(C2CC2N)cc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 11/20 0.66
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
ALDH1A1 P00352 1/20 0.48
TUBB4A P04350 3/20 0.46
TUBB P07437 3/20 0.46
TUBA3C P0DPH7 3/20 0.46
TUBA1B P68363 3/20 0.46
TUBA4A P68366 3/20 0.46
TUBB4B P68371 3/20 0.46
TUBB3 Q13509 3/20 0.46
TUBB2A Q13885 3/20 0.46
TUBB8 Q3ZCM7 3/20 0.46
TUBA3E Q6PEY2 3/20 0.46
TUBA1A Q71U36 3/20 0.46
TUBA1C Q9BQE3 3/20 0.46
TUBB6 Q9BUF5 3/20 0.46
TUBB2B Q9BVA1 3/20 0.46
TUBB1 Q9H4B7 3/20 0.46
ADRA1A P35348 2/20 0.45

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
SCHEMBL7002457 1.00 KDM1A (0.66) KDM1AMAOAMAOBALDH1A1TUBB4A
SCHEMBL7002459 1.00 KDM1A (0.66) KDM1AMAOAMAOBALDH1A1TUBB4A
SCHEMBL7092215 0.84 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL6996729 0.84 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL6996727 0.84 KDM1A (0.72) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL7002848 0.81 KDM1A (0.68) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL7002844 0.81 KDM1A (0.68) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL7092495 0.81 KDM1A (0.68) KDM1AMAOAMAOBTUBB4ATUBB
SCHEMBL30630927 0.79 KDM1A (1.00) KDM1AMAOAMAOB
SCHEMBL27440827 0.79 KDM1A (1.00) KDM1AMAOAMAOB

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-0996621-B1 TRIAZOLO[4,5-d]PYRIMIDINE DERIVATIVES AS ANTI-THROMBOTIC AGENTS ASTRAZENECA AB (SE) 2003-10-01 EP disclosed
EP-0996621-A1 NOVEL COMPOUNDS Astra Pharmaceuticals Limited (GB) 2000-05-03 EP disclosed
WO-1999005143-A1 NOVEL COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1999-02-04 WO disclosed