SCHEMBL6733180

SCHEMBL6733180

Cc1cc2nc(N3CCCC[C@H]3C(=O)O)oc2cc1C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
ELANE P08246 2/20 0.43
PTGES O14684 7/20 0.42
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
PDCD1 Q15116 4/20 0.39
CD274 Q9NZQ7 4/20 0.39

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
SCHEMBL6737804 0.87 GABRP (0.50) MAPTELANEPTGESALDH1A1HPGD
SCHEMBL7826244 0.81 FKBP1A (0.48) ELANE
SCHEMBL6737810 0.81 PTGES (0.56) PTGES
SCHEMBL6734526 0.81 ELANE (0.44) MAPTELANEPTGESALDH1A1HPGD
SCHEMBL6738108 0.81 GABRP (0.51) ELANEPTGESPDCD1CD274
SCHEMBL7685083 0.80 ELANE (0.56) MAPTELANEALDH1A1HPGD
SCHEMBL6733860 0.80 ELANE (0.56) MAPTELANEALDH1A1HPGD
Hydrochloric Acid SCHEMBL7654203 0.79 ELANE (0.55) MAPTELANEALDH1A1HPGD
SCHEMBL6738211 0.79 GABRP (0.42) ELANEALDH1A1HPGDPDCD1CD274
SCHEMBL6733622 0.78 PTGES (0.49) ELANEPTGESPDCD1CD274

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058905-A1 Immunosuppressants; Alzheimer's diseases; central nervous system disorders; strokes PFIZER INC. 2004-03-25 US disclosed
US-6686357-B1 BENZIMIDAZOLO-PIPERIDINE COMPOUND PFIZER, INC. 2004-02-03 US disclosed
US-6509464-B1 1-Heteroaryl-pyrrolidine, piperidine, or homopiperidine derivates; nervous system disorder treatment; amidation PFIZER INC 2003-01-21 US disclosed
US-6495549-B1 1-HETEROARYL-PIPERIDINE DERIVATIVES; MODERATING NEURONAL DEGENERATION; PROMOTING NEURONAL REGENERATION AND OUTGROWTH; TREATOG NEUROLOGICAL DISORDERS ARISING FROM NEURODEGENERATIVE DISEASES OR OTHER DISORDERS INVOLVING NERVE DAMAGE PFIZER INC 2002-12-17 US disclosed
EP-1098894-B1 FKBP INHIBITORS PFIZER LTD (GB) 2002-10-02 EP disclosed
CN-1315951-A FKBP inhibitors PFIZER LTD (US) 2001-10-03 CN disclosed
US-6166011-A FKBP inhibitors PFIZER INC (US) 2000-12-26 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-20040058905-A1 Immunosuppressants; Alzheimer's diseases; central nervous system disorders; strokes FKBP1A, FKBP4, FKBP1B MAPT 11/4885ELANE 4209/4885PTGES 2301/4885

“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.