SCHEMBL8501371

SCHEMBL8501371

COc1ccc2c(c1OC)CCC2NC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.57
KDM4E B2RXH2 3/20 0.57
POLB P06746 1/20 0.57
MAPT P10636 1/20 0.57
TUBB1 Q9H4B7 4/20 0.53
CYP2C9 P11712 3/20 0.53
TSHR P16473 2/20 0.53
KMT2A Q03164 2/20 0.53
TUBB4A P04350 2/20 0.53
TUBB P07437 2/20 0.53
TUBA3C P0DPH7 2/20 0.53
TUBA1B P68363 2/20 0.53
TUBA4A P68366 2/20 0.53
TUBB4B P68371 2/20 0.53
TUBB3 Q13509 2/20 0.53
TUBB2A Q13885 2/20 0.53
TUBB8 Q3ZCM7 2/20 0.53
TUBA3E Q6PEY2 2/20 0.53
TUBA1A Q71U36 2/20 0.53
TUBA1C Q9BQE3 2/20 0.53

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
SCHEMBL2465015 1.00 LMNA (0.57) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL8502533 1.00 LMNA (0.57) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL5262628 0.84 LMNA (0.43) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL11716633 0.83 MTNR1A (0.46) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL11720868 0.83 LMNA (0.71) LMNAKDM4EPOLBMAPTTUBB1
SCHEMBL10205808 0.78 PARP1 (0.47) LMNAKDM4EPOLBMAPTCYP1A2
SCHEMBL11001128 0.77 MTNR1A (0.66) MTNR1AMTNR1B
SCHEMBL17304592 0.76 PAX8 (0.53) LMNAKDM4EPOLBMAPTTUBB1
Acetic Acid SCHEMBL355654 0.76 ACHE (0.47) KDM4EMAPTTUBB1TUBB4ATUBB
SCHEMBL559163 0.75 PARP1 (0.47) KDM4EMAPTCYP1A2MTNR1AMTNR1B

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-5877218-A PARKINSON'S DISEASE; ANTIEPILEPSY AGENTS; ANTICONVULSANTS TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) 1999-03-02 US claimed