SCHEMBL3201238

SCHEMBL3201238

CN(c1ccccc1)C(c1cccc(F)c1)C(O)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 9/20 0.66
SLC6A4 P31645 9/20 0.66
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
OPRM1 P35372 2/20 0.40
OPRL1 P41146 2/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
CNR2 P34972 1/20 0.40
MTOR P42345 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL3197684 0.91 SLC6A2 (0.55) SLC6A2SLC6A4MEN1KMT2ACES2
SCHEMBL3190581 0.89 SLC6A2 (0.67) SLC6A2SLC6A4MEN1KMT2ACES2
SCHEMBL3197478 0.87 SLC6A2 (0.65) SLC6A2SLC6A4MEN1KMT2AOPRM1
SCHEMBL3190947 0.85 SLC6A2 (0.58) SLC6A2SLC6A4
SCHEMBL3190940 0.85 SLC6A2 (0.58) SLC6A2SLC6A4
SCHEMBL3202142 0.84 SLC6A2 (0.64) SLC6A2SLC6A4MEN1KMT2A
SCHEMBL3212996 0.84 SLC6A2 (0.60) SLC6A2SLC6A4MEN1KMT2AKDM4E
SCHEMBL3199011 0.80 SLC6A2 (0.50) SLC6A2SLC6A4KDM4E
SCHEMBL13422511 0.80 SLC6A2 (1.00) SLC6A2SLC6A4
SCHEMBL3188996 0.80 SLC6A2 (1.00) SLC6A2SLC6A4

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.