SCHEMBL5371391

SCHEMBL5371391

O=C(N1CCC[C@H](Oc2ccccc2Br)C1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HPGDS O60760 1/20 0.40
SCD O00767 1/20 0.40
DGAT2 Q96PD7 4/20 0.39
KDM4E B2RXH2 2/20 0.39
LOXL2 Q9Y4K0 3/20 0.38
SSTR1 P30872 1/20 0.38
SSTR4 P31391 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
LOX P28300 1/20 0.38
ATM Q13315 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
SCHEMBL5371393 1.00 MAPT (0.42) MAPTALDH1A1LMNANPSR1HPGD
SCHEMBL5425887 0.93 SCD (0.45) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL5425895 0.93 SCD (0.45) MAPTALDH1A1LMNANPSR1SMN1; SMN2
SCHEMBL14559939 0.81 PDE4B (0.50) MAPTALDH1A1LMNANPSR1HPGD
SCHEMBL5366144 0.81 PDE4B (0.50) MAPTALDH1A1LMNANPSR1HPGD
SCHEMBL5414961 0.81 PDE4B (0.50) MAPTALDH1A1LMNANPSR1HPGD
SCHEMBL5370297 0.80 HTR2C (0.42) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL14559987 0.80 HTR2C (0.42) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL2817663 0.78 EPHX2 (0.55) MAPTLMNANPSR1SCDKDM4E
SCHEMBL2817662 0.78 EPHX2 (0.55) MAPTLMNANPSR1SCDKDM4E

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-7186715-B2 Piperazine- and piperidine-derivatives as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-03-06 US disclosed
EP-1370558-B1 PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS LILLY CO ELI (US) 2005-08-24 EP disclosed
US-20040082590-A1 Piperazine- and piperidine-derivatives as melanocortin receptor agonists ELI LILLY AND COMPANY 2004-04-29 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-20040082590-A1 Piperazine- and piperidine-derivatives as melanocortin receptor agonists MC1R, MC4R, MC5R MAPT 3074/4885ALDH1A1 1078/4885LMNA 4588/4885

“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.