SCHEMBL9739685

SCHEMBL9739685

COc1ccc(Cc2ccc3[nH][c]cc3c2)c(OC)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.44
APLNR P35414 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CSF1R P07333 1/20 0.40
NTRK2 Q16620 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39
TUBA1A Q71U36 1/20 0.39
TUBA1C Q9BQE3 1/20 0.39
TUBB6 Q9BUF5 1/20 0.39
TUBB2B Q9BVA1 1/20 0.39

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
SCHEMBL9739054 0.83 IDO1 (0.44) PDE10AMEN1KMT2ACA2IDO1
SCHEMBL5612174 0.77 APLNR (0.59) APLNRCSF1RNTRK2TUBB4ATUBB
SCHEMBL315575 0.77 AXL (0.53) MEN1KMT2AGPR84CA2
SCHEMBL9738870 0.76 APLNR (0.42) PDE10AAPLNRCSF1RNTRK2GPR84
SCHEMBL9739261 0.76 TUBB4A (0.57) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL145084 0.74 APLNR (0.68) APLNRCA2CA12CA1CA7
SCHEMBL5612171 0.72 APLNR (0.53) PDE10AAPLNRTUBB4ATUBBTUBA3C
SCHEMBL9291320 0.72 MAPK1 (0.61) APLNRCSF1RNTRK2CA2CA12
SCHEMBL3300286 0.71 LTA4H (0.58) APLNR
SCHEMBL15759453 0.71 APLNR (0.51) APLNRKMT2ATUBB4ATUBBTUBA3C

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
US-5175157-A Cardiovascular disorders BOEHRINGER INGELHEIM GMBH (DE) 1992-12-29 US disclosed