SCHEMBL1168633

SCHEMBL1168633

N[C@H](CO)C1Cc2ccccc2C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.39
PLAU P00749 1/20 0.36
HTR2A P28223 3/20 0.35
RET P07949 1/20 0.35
HTR2C P28335 1/20 0.35
HRH1 P35367 1/20 0.35
ANPEP P15144 1/20 0.35
MAPT P10636 1/20 0.35
OPRD1 P41143 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33

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
SCHEMBL27518244 1.00 IDO1 (0.39) IDO1PLAUHTR2ARETHTR2C
SCHEMBL7113339 0.79 DRD3 (0.41) IDO1PLAUHTR2AOPRD1DPP4
Hydrochloric Acid SCHEMBL7112616 0.78 IDO1 (0.41) IDO1PLAUHTR2AANPEPOPRD1
SCHEMBL24890476 0.76 IDO1 (0.43) IDO1PLAUHTR2AANPEPDPP4
SCHEMBL7092681 0.75 IDO1 (0.46) IDO1PLAUHTR2ARETANPEP
SCHEMBL28785332 0.72 OPRD1 (0.40) IDO1OPRD1DPP4DPP8DPP9
SCHEMBL12804575 0.71 HTR2A (0.50) IDO1PLAUHTR2A
SCHEMBL12936160 0.71 HTR2A (0.50) IDO1PLAUHTR2A
SCHEMBL10290580 0.71 TACR1 (0.50) IDO1HTR2ARETHTR2CHRH1
SCHEMBL4666509 0.70 IDO1 (0.41) IDO1PLAUANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production WYETH LLC (US) 2011-02-10 US disclosed
US-7842718-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH LLC (US) 2010-11-30 US disclosed
US-7691884-B2 Heterocyclic sulfonamide inhibitors of β amyloid production WYETH (US) 2010-04-06 US disclosed
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2010-01-28 US disclosed
CN-1263750-C Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH CORP (US) 2006-07-12 CN disclosed
CN-1800176-A Heterocyclic sulfonamide inhibitors of beta amyloid production ARQULE (US) 2006-07-12 CN disclosed
EP-1341779-B1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH CORP (US) 2006-06-21 EP disclosed
US-20050196813-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-09-08 US disclosed
US-6878742-B2 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH (US) 2005-04-12 US disclosed
CN-1503790-A Heterocyclic sulfonamide inhibitors of beta amyloid production 2004-06-09 CN disclosed
US-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production WYETH 2003-12-11 US disclosed
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP disclosed
US-6610734-B2 For therapy of Alzheimer's Disease and Down's syndrome WYETH 2003-08-26 US disclosed
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production ARQULE 2002-12-05 US disclosed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 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 (4 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-20030229127-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 IDO1 3199/4885PLAU 3906/4885HTR2A 654/4885
US-20100022594-A1 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION APP, BACE1, PSEN1 IDO1 3277/4885PLAU 4036/4885HTR2A 391/4885
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production APP, BACE1, PSEN1 IDO1 3277/4885PLAU 4036/4885HTR2A 391/4885
US-20020183361-A1 Heterocyclic sulfonamide inhibitors of beta amyloid production APP, BACE1, PSEN1 IDO1 3199/4885PLAU 3906/4885HTR2A 654/4885

“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.