SCHEMBL7708520

SCHEMBL7708520

CCCCNc1ccc(C(=O)O)c(N(C)C)c1CC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 3/20 0.52
KDM6B O15054 2/20 0.52
HCAR3 P49019 3/20 0.42
CISD1 Q9NZ45 7/20 0.41
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
MAPK8 P45983 1/20 0.38
PLK1 P53350 3/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37

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
Hydrochloric Acid SCHEMBL28909832 0.87 KDM4C (0.50) KDM4CKDM6BHCAR3CISD1CYP2C9
SCHEMBL6413980 0.81 KDM6B (0.46) KDM4CKDM6BHCAR3CISD1CYP2C9
Hydrochloric Acid SCHEMBL9132968 0.80 KDM6B (0.53) KDM4CKDM6BHCAR3CISD1CYP2C9
SCHEMBL11252644 0.76 PLK1 (0.47) KDM4CKDM6BHCAR3CISD1CNR1
SCHEMBL29033346 0.75 KDM6B (0.57) KDM4CKDM6BHCAR3CISD1CYP2C9
SCHEMBL5889262 0.74 GRM2 (0.44) CYP2C9
SCHEMBL29634002 0.72 PPARA (0.47) PLK1
SCHEMBL9903584 0.72 PPARA (0.47) PLK1
SCHEMBL28912518 0.71 KDM6B (0.57) KDM4CKDM6BHCAR3CISD1CYP2C9
SCHEMBL16114874 0.71 ABCB11 (0.46) KDM4CKDM6BHCAR3CISD1HPGD

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-6358231-B1 Transdermal anesthetizing solution and method and apparatus for anesthetizing the ear canal and tympanic membrane BIOPOLYMER, INC. 2002-03-19 US disclosed