SCHEMBL6182404

SCHEMBL6182404

CCN(CC)C(=O)C1CCCN(C2CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)C1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 4/20 0.70
ACACA Q13085 4/20 0.70
CTSB P07858 1/20 0.49
KDM4E B2RXH2 2/20 0.45
LMNA P02545 1/20 0.45
CYP2C9 P11712 3/20 0.45
POLB P06746 1/20 0.44
CCR3 P51677 1/20 0.43
BCHE P06276 1/20 0.43
HPGD P15428 1/20 0.42
MBTD1 Q05BQ5 1/20 0.42
TP53BP1 Q12888 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM2B Q8NHM5 4/20 0.41

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
SCHEMBL6182181 0.89 ACACB (0.79) ACACBACACAKDM4ELMNAPOLB
SCHEMBL3462988 0.83 ACACB (1.00) ACACBACACAKDM4ELMNAPOLB
SCHEMBL977942 0.83 ACACB (1.00) ACACBACACAKDM4ELMNAPOLB
SCHEMBL3465044 0.83 ACACB (1.00) ACACBACACAKDM4ELMNAPOLB
SCHEMBL6183974 0.82 ACACB (0.78) ACACBACACAKDM4ELMNAPOLB
SCHEMBL6184040 0.81 CYP2C9 (0.72) ACACBACACAKDM4ELMNACYP2C9
SCHEMBL6181355 0.80 ACACB (0.94) ACACBACACAKDM4ELMNAPOLB
SCHEMBL6184046 0.79 ACACB (0.66) ACACBACACAKDM4ELMNACYP2C9
SCHEMBL6183674 0.79 ACACB (0.80) ACACBACACAKDM4ELMNAPOLB
SCHEMBL6498280 0.78 ACACB (0.91) ACACBACACAKDM4ELMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6979741-B2 Acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2005-12-27 US disclosed
EP-1478437-B1 ACC INHIBITORS PFIZER PROD INC (US) 2005-08-31 EP disclosed
US-20030187254-A1 Acetyl-CoA carboxylase inhibitors PFIZER INC. 2003-10-02 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-20030187254-A1 Acetyl-CoA carboxylase inhibitors ACACA, ACACB, ACAT1 ACACB 2/4885ACACA 1/4885CTSB 1423/4885

“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.