SCHEMBL6739003

SCHEMBL6739003

O=C(O)n1c(Cl)nc2c(F)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
MGAM O43451 1/20 0.37
AMY1A P0DUB6 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
PPARG P37231 1/20 0.37
EGLN1 Q9GZT9 1/20 0.36
AKR1A1 P14550 2/20 0.36
AKR1B1 P15121 2/20 0.36
RORC P51449 5/20 0.35
CYP3A4 P08684 2/20 0.35
DPP4 P27487 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
CYP2C9 P11712 2/20 0.33
CCR2 P41597 1/20 0.33
RARG P13631 1/20 0.33
LCK P06239 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL30685057 0.74 SMN1; SMN2 (0.50) GAALCKHTT
SCHEMBL6733842 0.73 SMN1; SMN2 (0.53) PTGDR2
SCHEMBL6740559 0.70 NR1H4 (0.37) CYP3A4CYP2C9HTT
SCHEMBL1537641 0.69 TSHR (0.37) GAALCK
SCHEMBL5121022 0.68 PTGDR2 (0.46) PPARGAKR1A1AKR1B1PTGDR2
SCHEMBL6738367 0.68 AGTR1 (0.40) CCR2DHODH
SCHEMBL15252645 0.66 KMT2A (0.47) GAAMGAMAMY1ASIMGAM2
SCHEMBL7342724 0.65 L3MBTL1 (0.43) PPARGLCK
SCHEMBL9356931 0.62 CYP11B2 (0.37) GAAMGAMAMY1ASIMGAM2
SCHEMBL5623181 0.62 FABP4 (0.48) CCR2CES2CES1

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 8 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
EP-1098894-A1 FKBP INHIBITORS Pfizer Limited (GB) 2001-05-16 EP disclosed
US-6166011-A FKBP inhibitors PFIZER INC (US) 2000-12-26 US disclosed
WO-2000005231-A1 FKBP INHIBITORS PFIZER LIMITED (GB) 2000-02-03 WO 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 GAA 2065/4885MGAM 2675/4885AMY1A 2093/4885

“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.