SCHEMBL7043355

SCHEMBL7043355

CC(C)c1c2nc(Cc3cccc(Cl)c3)[nH]c(=O)c2nn1C

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 4/20 0.64
▸ PDE9A O76083 1/20 0.64
▸ PDE1A P54750 1/20 0.64
▸ PDE1B Q01064 1/20 0.64
▸ PDE1C Q14123 1/20 0.64
▸ CCNE2 O96020 7/20 0.43
▸ CCNE1 P24864 7/20 0.43
▸ CDK2 P24941 7/20 0.43
▸ CDK4 P11802 5/20 0.41
▸ CCND1 P24385 5/20 0.41
▸ CCNB2 O95067 4/20 0.41
▸ CDK1 P06493 4/20 0.41
▸ CCNB1 P14635 4/20 0.41
▸ CCNB3 Q8WWL7 4/20 0.41
▸ CCR2 P41597 2/20 0.41
▸ CCR5 P51681 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ PNP P00491 1/20 0.40

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
SCHEMBL3494823 0.75 PDE5A (0.71) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL6372391 0.71 PDE5A (0.62) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL3492113 0.68 PDE5A (0.59) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL401142 0.68 PDE5A (0.64) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL38205 0.67 PDE5A (0.64) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL8620381 0.66 ALDH1A1 (0.58) POLB
SCHEMBL2110230 0.66 PDE9A (0.57) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL6365929 0.66 PDE5A (0.53) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL941211 0.65 PDE5A (0.64) PDE5APDE9APDE1APDE1BPDE1C
SCHEMBL2769751 0.65 CDK4 (0.51) PDE5APDE9APDE1APDE1BPDE1C

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-20030195205-A1 PDE9 inhibitors for treating cardiovascular disorders PFIZER INC. 2003-10-16 — — 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-20030195205-A1 PDE9 inhibitors for treating cardiovascular disorders PDE9A, PDE2A, PDE3A PDE5A 6/4885PDE9A 1/4885PDE1A 62/4885

“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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