SCHEMBL5371269

SCHEMBL5371269

CCNC(C)COc1ccccc1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 1/20 0.48
ATM Q13315 1/20 0.48
HTR7 P34969 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
POLB P06746 1/20 0.39
ADRB2 P07550 3/20 0.38
ADRB1 P08588 3/20 0.38
ADRB3 P13945 1/20 0.38
MAOA P21397 1/20 0.38
PTGS1 P23219 1/20 0.38
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
LMNA P02545 2/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL5371265 1.00 KMT2A (0.48) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL29671577 0.78 KMT2A (0.59) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL6468101 0.78 KMT2A (0.59) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL27514088 0.77 KMT2A (0.51) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL5370551 0.76 MTNR1A (0.63) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL5370545 0.76 MTNR1A (0.63) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL7383196 0.76 MTNR1A (0.51) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL7383193 0.76 MTNR1A (0.51) KMT2AMEN1SMN1; SMN2GAAATM
SCHEMBL8817579 0.75 HTR1B (0.49) KMT2AMEN1GAASIGMAR1ADRB2
SCHEMBL20385338 0.75 MAOA (0.65) KMT2AMEN1SIGMAR1ADRB2ADRB1

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 5 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
EP-1370558-A1 PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-12-17 EP disclosed
WO-2002059117-A1 PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 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-20040082590-A1 Piperazine- and piperidine-derivatives as melanocortin receptor agonists MC1R, MC4R, MC5R KMT2A 2374/4885MEN1 1206/4885SMN1; SMN2 3078/4885

“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.