SCHEMBL5981609

SCHEMBL5981609

O=C(Nc1cccc2cccnc12)C(=S)c1cn(Cc2ccc(Cl)cc2)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53
TUBA3C P0DPH7 1/20 0.53
TUBA1B P68363 1/20 0.53
TUBA4A P68366 1/20 0.53
TUBB4B P68371 1/20 0.53
TUBB3 Q13509 1/20 0.53
TUBB2A Q13885 1/20 0.53
TUBB8 Q3ZCM7 1/20 0.53
TUBA3E Q6PEY2 1/20 0.53
TUBA1A Q71U36 1/20 0.53
TUBA1C Q9BQE3 1/20 0.53
TUBB6 Q9BUF5 1/20 0.53
TUBB2B Q9BVA1 1/20 0.53
TUBB1 Q9H4B7 1/20 0.53
CNR2 P34972 1/20 0.48
KDR P35968 5/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 3/20 0.46

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
SCHEMBL5573030 0.91 TUBB4A (0.65) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5573795 0.82 TUBB4A (0.56) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5982035 0.78 TUBB4A (0.60) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5572465 0.75 TUBB4A (0.69) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL26494977 0.74 MAPT (0.62) CNR2KDRMAPTKDM4ESMN1; SMN2
SCHEMBL30373905 0.74 MAPT (0.62) CNR2KDRMAPTKDM4ESMN1; SMN2
SCHEMBL6195457 0.73 TUBB4A (0.49) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29409455 0.73 TUBB4A (0.68) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5346065 0.73 TUBB4A (0.68) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4019994 0.72 PDE4A (0.61) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641777-A1 INDOLE DERIVATIVES WITH APOPTOSIS-INDUCING EFFECT Zentaris GmbH (DE) 2006-04-05 EP claimed
EP-1595878-A1 INDOLE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY Zentaris GmbH (DE) 2005-11-16 EP claimed
WO-2004108702-A1 INDOLE DERIVATIVES WITH APOPTOSIS-INDUCING EFFECT ZENTARIS GMBH (DE) 2004-12-16 WO claimed
EP-1484329-A1 Indole derivatives with apoptosis inducing activity Zentaris GmbH (DE) 2004-12-08 EP claimed
EP-1641777-A1 INDOLE DERIVATIVES WITH APOPTOSIS-INDUCING EFFECT Zentaris GmbH (DE) 2006-04-05 EP disclosed
EP-1595878-A1 INDOLE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY Zentaris GmbH (DE) 2005-11-16 EP disclosed
WO-2004108702-A1 INDOLE DERIVATIVES WITH APOPTOSIS-INDUCING EFFECT ZENTARIS GMBH (DE) 2004-12-16 WO disclosed
EP-1484329-A1 Indole derivatives with apoptosis inducing activity Zentaris GmbH (DE) 2004-12-08 EP disclosed