SCHEMBL6808203

SCHEMBL6808203

CC1CN(c2ccc(F)c3cc(F)ccc23)CCN1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ CHRM4 P08173 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HSD11B1 P28845 9/20 0.41
▸ SMO Q99835 1/20 0.40
▸ GRM1 Q13255 1/20 0.40
▸ ROCK2 O75116 1/20 0.38
▸ PRKG1 Q13976 1/20 0.38

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
SCHEMBL6808198 1.00 MAPT (0.45) MAPTCHRM4ALDH1A1LMNAHSD11B1
SCHEMBL6811731 0.88 HSD11B1 (0.42) MAPTCHRM4ALDH1A1LMNAHSD11B1
SCHEMBL6811721 0.88 HSD11B1 (0.42) MAPTCHRM4ALDH1A1LMNAHSD11B1
SCHEMBL28094549 0.77 MAPT (0.53) MAPTCHRM4ALDH1A1LMNAROCK2
SCHEMBL20874064 0.77 MAPT (0.53) MAPTCHRM4ALDH1A1LMNAROCK2
SCHEMBL4573282 0.76 HSD11B1 (0.45) CHRM4HSD11B1
SCHEMBL9959713 0.75 NOTUM (0.54) MAPTCHRM4ALDH1A1LMNASMO
SCHEMBL6811374 0.74 HTR2C (0.44) MAPTALDH1A1LMNAHSD11B1
SCHEMBL6811380 0.74 HTR2C (0.44) MAPTALDH1A1LMNAHSD11B1
SCHEMBL20266344 0.73 GRM1 (0.47) MAPTCHRM4SMOGRM1ROCK2

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-20040122001-A1 Pharmaceutical compounds ELI LILLY AND COMPANY 2004-06-24 — — US disclosed
EP-1345930-A2 PHARMACEUTICAL COMPOUNDS ELI LILLY AND COMPANY (US) 2003-09-24 — — EP disclosed
WO-2002050067-A2 PHARMACEUTICAL HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 2002-06-27 — — 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-20040122001-A1 Pharmaceutical compounds CYP2D6, LPXN, CYP1B1 MAPT 2401/4885CHRM4 794/4885ALDH1A1 1563/4885

“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.

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