SCHEMBL1364506

SCHEMBL1364506

O=C(NC1CCN(C2Cc3ccccc3C2)C1=O)c1cnc(-c2cccc(F)c2)nc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.42
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41
▸ TAS1R2 Q8TE23 1/20 0.41
▸ GRM5 P41594 15/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ HTR7 P34969 2/20 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
SCHEMBL1366736 0.75 HPGDS (0.44) HPGDSDRD2DRD4
SCHEMBL1364946 0.75 DRD4 (0.43) HPGDSGRM5DRD2DRD4
SCHEMBL1367373 0.74 HPGDS (0.41) HPGDSGRM5DRD2DRD4HTR7
SCHEMBL1364881 0.74 HPGDS (0.41) HPGDSDRD2HTR7
SCHEMBL1366908 0.73 HPGDS (0.41) HPGDSDRD2DRD4
SCHEMBL1366021 0.70 DRD2 (0.52) HPGDSGRM5DRD2DRD4HTR7
SCHEMBL10252034 0.70 GABRA5 (0.58) HPGDSGRM5
SCHEMBL1365098 0.70 HPGDS (0.52) HPGDSGRM5DRD2HTR7
SCHEMBL1368210 0.70 HPGDS (0.55) HPGDSGRM5DRD2DRD4HTR7
SCHEMBL1365691 0.69 MAP4K4 (0.59) HPGDSGRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067589-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2011-11-29 — — US disclosed
US-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions BLAKE TANISHA D 2009-11-12 — — US disclosed
US-7582643-B2 Heterocyclic compounds useful in treating diseases and conditions PFIZER INC (US) 2009-09-01 — — US disclosed
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions BLAKE TANISHA D 2008-08-28 — — US 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 (2 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-20090281125-A1 Heterocyclic Compounds Useful in Treating Diseases and Conditions CYP11B2, CYP11B1, LTC4S HPGDS 99/4885TAS1R3 4260/4885TAS1R1 3940/4885
US-20080207651-A1 Heterocyclic compounds useful in treating diseases and conditions CYP11B2, CYP11B1, LTC4S HPGDS 99/4885TAS1R3 4260/4885TAS1R1 3940/4885

“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.

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