SCHEMBL7439134

SCHEMBL7439134

COc1ccc2c(c1OC)CC(c1ccccc1)C(CCO)[C@H]2CN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.36
MAOB P27338 4/20 0.36
MAOA P21397 3/20 0.36
ADRA1A P35348 2/20 0.35
TUBB4A P04350 3/20 0.34
TUBB P07437 3/20 0.34
TUBA3C P0DPH7 3/20 0.34
TUBA1B P68363 3/20 0.34
TUBA4A P68366 3/20 0.34
TUBB4B P68371 3/20 0.34
TUBB3 Q13509 3/20 0.34
TUBB2A Q13885 3/20 0.34
TUBB8 Q3ZCM7 3/20 0.34
TUBA3E Q6PEY2 3/20 0.34
TUBA1A Q71U36 3/20 0.34
TUBA1C Q9BQE3 3/20 0.34
TUBB6 Q9BUF5 3/20 0.34
TUBB2B Q9BVA1 3/20 0.34
TUBB1 Q9H4B7 3/20 0.34
HTR2C P28335 2/20 0.34

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
SCHEMBL7439138 1.00 KDM1A (0.36) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL9040854 0.94 KDM1A (0.35) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL9042337 0.94 KDM1A (0.35) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL9039255 0.90 KDM1A (0.37) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL9040240 0.90 KDM1A (0.37) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL10380075 0.85 ADRA1A (0.41) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL7304489 0.82 KDM1A (0.39) KDM1AMAOBMAOAADRA1ATUBB4A
SCHEMBL7443896 0.79 DRD1 (0.35)
SCHEMBL7440991 0.78 DRD1 (0.50) ADRA1AADRA1DADRA1B
SCHEMBL8829246 0.78 DRD1 (0.50) ADRA1AADRA1DADRA1B

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-1996038435-A1 DOPAMINE AGONISTS ABBOTT LABORATORIES (US) 1996-12-05 WO disclosed