SCHEMBL5774902

SCHEMBL5774902

CN1CCCC1Oc1cccc2c1CCN(C(=O)O)C2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 2/20 0.45
CPT1A P50416 2/20 0.45
ABHD6 Q9BV23 4/20 0.43
UCHL1 P09936 1/20 0.41
ACACB O00763 2/20 0.39
PDE4B Q07343 3/20 0.38
HTR7 P34969 1/20 0.38
AKR1C3 P42330 1/20 0.36
S1PR5 Q9H228 1/20 0.36
KDM1A O60341 1/20 0.36
KEAP1 Q14145 1/20 0.36

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
SCHEMBL5778766 0.82 KDM4E (0.48) CPT2CPT1AABHD6ACACBPDE4B
SCHEMBL17607362 0.82 ACACB (0.51) CPT2CPT1AABHD6ACACBPDE4B
SCHEMBL5773562 0.82 KDM4E (0.43) CPT2CPT1AABHD6UCHL1ACACB
SCHEMBL5777671 0.81 CHRNB4 (0.51) CPT2CPT1A
SCHEMBL5777017 0.75 CD44 (0.42)
SCHEMBL5775315 0.74 ABHD6 (0.46) CPT2CPT1AABHD6UCHL1AKR1C3
SCHEMBL28864977 0.72 ABHD6 (0.49) CPT2CPT1AABHD6
SCHEMBL5773186 0.71 HRH3 (0.47) CPT2CPT1AABHD6ACACBS1PR5
SCHEMBL22319858 0.70 ABHD6 (0.55) CPT2CPT1AABHD6ACACBS1PR5
SCHEMBL17583926 0.70 KDM1A (0.53) ABHD6UCHL1ACACBPDE4BKDM1A

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
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 CPT2 1256/4885CPT1A 264/4885ABHD6 219/4885

“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.