SCHEMBL4580915

SCHEMBL4580915

N#Cc1ccc(-c2ccc3n2CCCC3=O)cc1F

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 10/20 0.48
CYP11B1 P15538 5/20 0.48
CYP11B2 P19099 5/20 0.48
KDM1A O60341 4/20 0.41
KCNJ1 P48048 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL14177841 0.81 KCNJ1 (0.39) EGLN2CYP11B1CYP11B2KCNJ1KCNH2
SCHEMBL4580999 0.76 CYP11B1 (0.46) EGLN2CYP11B1CYP11B2KDM1A
SCHEMBL4579729 0.74 PRKCQ (0.38)
SCHEMBL4578838 0.69 CYP11B1 (0.46) EGLN2CYP11B1CYP11B2KDM1AKCNJ1
SCHEMBL18297999 0.69 CYP11B2 (0.67) CYP11B1CYP11B2
SCHEMBL9612021 0.67 CYP11B2 (0.68) CYP11B1CYP11B2
SCHEMBL7275484 0.66 CYP11B2 (0.47) EGLN2CYP11B1CYP11B2
SCHEMBL12819922 0.65 CYP11B1 (0.47) EGLN2CYP11B1CYP11B2KDM1A
SCHEMBL14637928 0.65 PARP1 (0.42) EGLN2CYP11B1CYP11B2KDM1AKCNJ1
SCHEMBL16771978 0.64 TRPV4 (0.52) EGLN2CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives SERENEX, INC. 2008-05-22 US claimed
WO-2008024978-A2 TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES SERENEX, INC. (US) 2008-02-28 WO claimed
US-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives SERENEX, INC. 2008-05-22 US disclosed
US-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives SERENEX, INC. 2008-05-22 US disclosed
US-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives SERENEX, INC. 2008-05-22 US disclosed
WO-2008024978-A2 TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES SERENEX, INC. (US) 2008-02-28 WO disclosed
WO-2008024978-A2 TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES SERENEX, INC. (US) 2008-02-28 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-20080119457-A1 Benzene, Pyridine, and Pyridazine Derivatives MKI67, CCNB1, RB1 EGLN2 1441/4885CYP11B1 380/4885CYP11B2 572/4885

“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.