SCHEMBL5849758

SCHEMBL5849758

COc1ccc([C@@H](C)N2CCN(c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 1/20 0.46
HSD17B10 Q99714 1/20 0.45
OGA O60502 3/20 0.43
HIF1A Q16665 5/20 0.43
UTS2R Q9UKP6 3/20 0.42
ACACB O00763 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL4708524 1.00 SMN1; SMN2 (0.46) SMN1; SMN2MAPTHSD17B10OGAHIF1A
SCHEMBL14453013 1.00 SMN1; SMN2 (0.46) SMN1; SMN2MAPTHSD17B10OGAHIF1A
SCHEMBL4712115 0.94 OGA (0.48) SMN1; SMN2MAPTHSD17B10OGAMEN1
SCHEMBL4709563 0.92 HSD17B10 (0.44) SMN1; SMN2MAPTHSD17B10OGAACACB
SCHEMBL4710443 0.88 MAPT (0.47) SMN1; SMN2MAPTOGAHIF1AUTS2R
SCHEMBL5524464 0.88 MAPT (0.47) SMN1; SMN2MAPTOGAHIF1AUTS2R
SCHEMBL4709595 0.88 MAPT (0.47) SMN1; SMN2MAPTOGAHIF1AUTS2R
SCHEMBL4710567 0.87 SMN1; SMN2 (0.47) SMN1; SMN2MAPTHSD17B10HIF1AUTS2R
SCHEMBL6623525 0.87 MAPT (0.39) SMN1; SMN2MAPTHSD17B10OGAHIF1A
SCHEMBL4709090 0.86 OGA (0.53) OGAHIF1AUTS2R

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241765-B2 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues NEUROGEN CORPORATION (US) 2007-07-10 US disclosed
US-7241765-B2 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues NEUROGEN CORPORATION (US) 2007-07-10 US disclosed
US-20060229298-A1 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues HUTCHISON ALAN 2006-10-12 US disclosed
US-7081458-B2 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues NEUROGEN CORP. (US) 2006-07-25 US disclosed
US-6953801-B2 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues NEUROGEN CORPORATION (US) 2005-10-11 US disclosed
US-20050182068-A1 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues HUTCHISON ALAN (US) 2005-08-18 US disclosed
US-20050065162-A1 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION 2005-03-24 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 (3 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-20060229298-A1 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues MCHR1, MCHR2, MC1R SMN1; SMN2 1441/4885MAPT 2914/4885HSD17B10 1537/4885
US-20050065162-A1 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES MCHR1, MCHR2, MC1R SMN1; SMN2 1441/4885MAPT 2914/4885HSD17B10 1537/4885
US-20050182068-A1 Melanin concentrating hormone receptor ligands: substituted 1-benzyl-4-aryl piperazine analogues MCHR1, MCHR2, MC1R SMN1; SMN2 1441/4885MAPT 2914/4885HSD17B10 1537/4885

“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.