SCHEMBL6044979

SCHEMBL6044979

O=C(O)c1c(F)cc2c(nnn2CC(F)(F)F)c1F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 4/20 0.33
KDM4C Q9H3R0 1/20 0.32
TDO2 P48775 2/20 0.31
KCNJ6 P48051 1/20 0.31
KCNJ5 P48544 1/20 0.31
KCNJ3 P48549 1/20 0.31
RORC P51449 1/20 0.30

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
SCHEMBL6685411 0.77 KDM4C (0.39) HCAR3KDM4CTDO2RORC
SCHEMBL6043860 0.76
SCHEMBL6044534 0.76 HCAR3 (0.35) HCAR3
SCHEMBL6044659 0.74 HCAR3 (0.39) HCAR3KDM4CTDO2
SCHEMBL6043601 0.73 KDM4C (0.34) KDM4CKCNJ6KCNJ5KCNJ3
SCHEMBL6043996 0.71 HCAR3 (0.50) HCAR3
SCHEMBL6043680 0.69 HCAR3 (0.68) HCAR3TDO2
SCHEMBL6044743 0.69 HCAR3 (0.52) HCAR3
SCHEMBL6044146 0.69 HCAR3 (0.42) HCAR3TDO2
SCHEMBL6044420 0.68 KDM4C (0.36) HCAR3KDM4CTDO2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060122240-A1 Benzotriazoles and methods of prophylaxis or treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2006-06-08 US disclosed
WO-2004041274-A1 BENZOTRIAZOLES AND METHODS OF PROPHYLAXIS OR TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2004-05-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122240-A1 Benzotriazoles and methods of prophylaxis or treatment of metabolic-related disorders thereof GCGR, GPR119, HMGCR HCAR3 85/4885KDM4C 3633/4885TDO2 927/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.