SCHEMBL4592557

SCHEMBL4592557

CN(C(=O)C1CC1)N1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
DPP4 P27487 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
BCHE P06276 2/20 0.32
TSHR P16473 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MAPT P10636 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
CCR5 P51681 1/20 0.30

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
SCHEMBL4591965 0.98 HPGD (0.43) HPGDDPP4MEN1KMT2ASMN1; SMN2
SCHEMBL4591962 0.74 HPGD (0.33) HPGDPOLB
SCHEMBL6632132 0.72 ALDH1A1 (0.36) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL4591961 0.72 CHRM2 (0.38) HPGDDPP4MEN1KMT2ASMN1; SMN2
SCHEMBL4592224 0.71 L3MBTL1 (0.32) HPGDMEN1KMT2AALDH1A1SIGMAR1
SCHEMBL4592553 0.71 MEN1 (0.33) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10782723 0.70 L3MBTL1 (0.32)
SCHEMBL4592349 0.70 CHRM2 (0.37) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL19032129 0.70 NOTUM (0.43) MEN1KMT2ASMN1; SMN2POLBHTT
SCHEMBL4591978 0.70 L3MBTL1 (0.34) HPGDMEN1KMT2AALDH1A1POLB

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
EP-1943231-A1 (HETERO)ARYL COMPOUNDS WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-07-16 EP disclosed
US-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds ROTH GERALD J 2007-05-17 US disclosed
WO-2007048802-A1 (HETERO)ARYL COMPOUNDS WITH MCH ANTAGONISTIC ACTIVITY AND MEDICAMENTS COMPRISING THESE COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-05-03 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-20070111981-A1 New (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds MCHR1, GPR119, MCHR2 HPGD 3220/4885DPP4 922/4885MEN1 2624/4885

“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.