SCHEMBL6370895

SCHEMBL6370895

CCCCOc1ccc(Cc2nc3c(C(C)C)n[nH]c3c(=O)[nH]2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 7/20 0.46
CCNK O75909 1/20 0.44
CCND3 P30281 1/20 0.44
GSK3B P49841 1/20 0.44
CDK7 P50613 1/20 0.44
CDK9 P50750 1/20 0.44
CCNH P51946 1/20 0.44
CDK6 Q00534 1/20 0.44
CDK12 Q9NYV4 1/20 0.44
PDE9A O76083 2/20 0.40
PDE1A P54750 2/20 0.40
PDE1B Q01064 2/20 0.40
PDE1C Q14123 2/20 0.40
LMNA P02545 2/20 0.40
PDE5A O76074 1/20 0.40
NPC1 O15118 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL6367361 0.87 SMN1; SMN2 (0.46) CCNKCCND3GSK3BCDK7CDK9
SCHEMBL6367309 0.85 PDE9A (0.53) CCNKCCND3GSK3BCDK7CDK9
SCHEMBL6366948 0.84 PDE9A (0.46) CCNKCCND3GSK3BCDK7CDK9
SCHEMBL6366064 0.84 GRIN1 (0.47) PDE9APDE1APDE1BPDE1CLMNA
SCHEMBL6367562 0.82 PDE9A (0.52) CCNKCCND3GSK3BCDK7CDK9
SCHEMBL6366055 0.82 PDE9A (0.51) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6367134 0.80 PDE9A (0.45) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6371780 0.80 PLA2G2A (0.43) PLA2G2ALMNANPC1TSHRHTT
SCHEMBL6367439 0.79 PDE9A (0.50) PDE9APDE1APDE1BPDE1CPDE5A
SCHEMBL6367248 0.79 PDE2A (0.45) 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 PLA2G2A 623/4885CCNK 4143/4885CCND3 4743/4885

“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.