SCHEMBL29311672

SCHEMBL29311672

Cc1ccc(-n2ccc(C#N)cc2=O)cn1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.41
PRMT5 O14744 1/20 0.41
ELANE P08246 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
NOX4 Q9NPH5 1/20 0.36
DGAT1 O75907 2/20 0.35
CYP19A1 P11511 1/20 0.35
CYP11B2 P19099 2/20 0.34
CYP11B1 P15538 1/20 0.34
HTR1A P08908 1/20 0.34

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
SCHEMBL22241839 0.82 POLB (0.42) PRMT5GPR119CYP19A1CYP11B2
SCHEMBL29310617 0.82 PRMT5 (0.43) PRMT5GPR119NOX4CYP19A1CYP11B2
SCHEMBL15742146 0.79 CDC7 (0.51) DGAT1CYP19A1CYP11B2
SCHEMBL30109054 0.79 CYP11B2 (0.53) CYP19A1CYP11B2CYP11B1
SCHEMBL6658922 0.75 CYP17A1 (0.41) DGAT1CYP19A1CYP11B2CYP11B1
SCHEMBL29311895 0.72 CCR6 (0.41)
SCHEMBL1044182 0.71 ELANE (0.45) PRMT5ELANE
SCHEMBL8337902 0.70 CYP2A6 (0.49) ELANECYP19A1
SCHEMBL21463653 0.70 LRRK2 (0.45)
SCHEMBL30615479 0.70 LRRK2 (0.45)

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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2024-07-11 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 (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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF PCSK9, PCSK7, PCSK6 MCHR1 2034/4885PRMT5 3713/4885ELANE 642/4885

“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.