SCHEMBL6367361

SCHEMBL6367361

COc1ccc(Cc2nc3c(C(C)C)n[nH]c3c(=O)[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
ADORA3 P0DMS8 1/20 0.43
PDE9A O76083 3/20 0.43
PDE1A P54750 3/20 0.43
PDE1B Q01064 3/20 0.43
PDE1C Q14123 3/20 0.43
PDE5A O76074 1/20 0.43
ALPL P05186 1/20 0.43
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 2/20 0.40
TYMP P19971 1/20 0.40
CCNB2 O95067 1/20 0.40
CCNE2 O96020 1/20 0.40
CDK1 P06493 1/20 0.40
CDK4 P11802 1/20 0.40
CCNB1 P14635 1/20 0.40
CCND1 P24385 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 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
SCHEMBL6366948 0.88 PDE9A (0.46) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6366064 0.88 GRIN1 (0.47) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6367368 0.87 PNP (0.50) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6368253 0.87 PDE9A (0.52) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6370895 0.87 PLA2G2A (0.46) SMN1; SMN2PDE9APDE1APDE1BPDE1C
SCHEMBL6367562 0.86 PDE9A (0.52) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6366736 0.86 PDE9A (0.44) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6366055 0.85 PDE9A (0.51) ADORA3PDE9APDE1APDE1BPDE1C
SCHEMBL6367309 0.85 PDE9A (0.53) SMN1; SMN2ADORA3PDE9APDE1APDE1B
SCHEMBL6366904 0.84 PDE9A (0.50) PDE9APDE1APDE1BPDE1CPDE5A

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-6967204-B2 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC (US) 2005-11-22 US disclosed
US-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC 2005-03-31 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-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors GPR119, PDE2A, PDE9A SMN1; SMN2 2040/4885ADORA3 1281/4885PDE9A 3/4885

“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.