SCHEMBL5331387

SCHEMBL5331387

COc1ccc(N(C)c2ncc(C)c3sc(C)cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.43
PDGFRB P09619 5/20 0.43
KDR P35968 5/20 0.43
TUBB3 Q13509 4/20 0.43
TUBB4A P04350 2/20 0.43
TUBB P07437 2/20 0.43
TUBA3C P0DPH7 2/20 0.43
TUBA1B P68363 2/20 0.43
TUBA4A P68366 2/20 0.43
TUBB4B P68371 2/20 0.43
TUBB2A Q13885 2/20 0.43
TUBB8 Q3ZCM7 2/20 0.43
TUBA3E Q6PEY2 2/20 0.43
TUBA1A Q71U36 2/20 0.43
TUBA1C Q9BQE3 2/20 0.43
TUBB6 Q9BUF5 2/20 0.43
TUBB2B Q9BVA1 2/20 0.43
TUBB1 Q9H4B7 2/20 0.43
PDGFRA P16234 1/20 0.43
CSF1R P07333 3/20 0.41

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
SCHEMBL5579182 0.78 RAB9A (0.55) EGFRPDGFRBKDRTUBB3TUBB4A
Hydrochloric Acid SCHEMBL5579229 0.77 RAB9A (0.57) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL5339148 0.72 DHFR (0.39) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL11432404 0.67 TUBB4A (0.48) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL5579172 0.65 TUBB3 (0.53) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL114319 0.64 CA1 (0.61) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL5579326 0.64 CSF1R (0.50) EGFRPDGFRBKDRTUBB3TUBB4A
SCHEMBL6181267 0.64 CSF1R (0.80) EGFRPDGFRBKDRPDGFRACSF1R
SCHEMBL5579174 0.64 RAB9A (0.62) EGFRPDGFRBKDRTUBB3TUBB4A
Hydrochloric Acid SCHEMBL6180769 0.63 CSF1R (0.81) EGFRPDGFRBKDRPDGFRACSF1R

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
WO-2007056214-A2 N-ALKYL-N-ARYL-THIENOPYRIMIDIN-R-AMINES AND USES THEREOF CYTOVIA, INC (US) 2007-05-18 WO disclosed