SCHEMBL3207091

SCHEMBL3207091

CCNC(=O)C(O)C(c1ccccc1)N(C)c1ccc(C)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 9/20 0.57
SLC6A4 P31645 9/20 0.57
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PKM P14618 2/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
CASR P41180 1/20 0.38
PSMB5 P28074 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
SCHEMBL3191686 0.85 SLC6A2 (0.61) SLC6A2SLC6A4MEN1KMT2ATP53
SCHEMBL3199946 0.84 SLC6A2 (0.58) SLC6A2SLC6A4MEN1KMT2APKM
SCHEMBL3189006 0.82 SLC6A2 (0.59) SLC6A2SLC6A4TP53MAPTALDH1A1
SCHEMBL3206018 0.81 SLC6A2 (0.61) SLC6A2SLC6A4MEN1KMT2APKM
SCHEMBL3201198 0.76 SLC6A2 (0.57) SLC6A2SLC6A4
SCHEMBL3201209 0.76 SLC6A2 (0.57) SLC6A2SLC6A4
SCHEMBL13422602 0.76 SLC6A2 (0.76) SLC6A2SLC6A4TP53MAPT
SCHEMBL3199676 0.76 SLC6A2 (0.76) SLC6A2SLC6A4TP53MAPT
Hydrochloric Acid SCHEMBL3211673 0.75 SLC6A2 (0.74) SLC6A2SLC6A4TP53MAPT
SCHEMBL3212916 0.75 SLC6A2 (0.46) SLC6A2SLC6A4ALDH1A1CNR2

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-7671238-B2 Arylamino-arylpropanolamine derivatives and methods of their use WYETH LLC (US) 2010-03-02 US disclosed
WO-2008042362-A1 ARYLAMINO-ARYLPROPANOLAMINE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-04-10 WO disclosed
US-20080085938-A1 Arylamino-Arylpropanolamine Derivatives and Methods of Their Use WYETH (US) 2008-04-10 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-20080085938-A1 Arylamino-Arylpropanolamine Derivatives and Methods of Their Use PNMT, PAH, SLC18A2 SLC6A2 4/4885SLC6A4 6/4885MEN1 3474/4885

“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.