SCHEMBL11265197

SCHEMBL11265197

CCCCc1ccc2[nH]c(NC#N)nc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 8/20 0.51
TUBB P07437 8/20 0.51
TUBA3C P0DPH7 8/20 0.51
TUBA1B P68363 8/20 0.51
TUBA4A P68366 8/20 0.51
TUBB4B P68371 8/20 0.51
TUBB3 Q13509 8/20 0.51
TUBB2A Q13885 8/20 0.51
TUBB8 Q3ZCM7 8/20 0.51
TUBA3E Q6PEY2 8/20 0.51
TUBA1A Q71U36 8/20 0.51
TUBA1C Q9BQE3 8/20 0.51
TUBB6 Q9BUF5 8/20 0.51
TUBB2B Q9BVA1 8/20 0.51
TUBB1 Q9H4B7 8/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
TSHR P16473 1/20 0.51
HIF1A Q16665 1/20 0.51

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
SCHEMBL11265201 0.90 TUBB4A (0.62) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL19191488 0.86 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL9860002 0.80 TUBB4A (0.63) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL14519982 0.80 TUBB4A (0.51) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Parbendazole SCHEMBL259455 0.78 TUBB4A (0.82) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
Parbendazole SCHEMBL29409286 0.78 TUBB4A (0.82) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL17702654 0.78 TUBB4A (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL8083834 0.77 TUBB4A (0.43) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3500724 0.77 ATP4A (0.46) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL11120640 0.76 TUBB4A (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4321393-A Method for preparing 2-cyanamidobenzimidazoles or 2-cyanamidobenzoxazoles SMITHKLINE CORPORATION (US) 1982-03-23 US disclosed
US-4285878-A N-Phenyl-N'-cyano-O-phenylisoureas SMITHKLINE CORPORATION (US) 1981-08-25 US disclosed