SCHEMBL22112308

SCHEMBL22112308

CC(C)NC(C=O)Cc1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.47
SLC6A2 P23975 1/20 0.47
ESR1 P03372 5/20 0.46
ESR2 Q92731 5/20 0.46
ACE P12821 1/20 0.43
CTSB P07858 2/20 0.41
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FOLH1 Q04609 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
SLC7A5 Q01650 1/20 0.40
MIF P14174 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
SCHEMBL12703579 0.83 ACE (0.43) TAAR1SLC6A2ESR1ESR2ACE
SCHEMBL4541734 0.82 TAAR1 (0.46) TAAR1SLC6A2ESR1ESR2CTSB
SCHEMBL9630785 0.82 TAAR1 (0.46) TAAR1SLC6A2ESR1ESR2CTSB
SCHEMBL12873856 0.82 ACE (0.56) TAAR1ACECTSB
SCHEMBL10044549 0.82 ACE (0.56) TAAR1ACECTSB
SCHEMBL12154596 0.82 TAAR1 (0.46) TAAR1SLC6A2ESR1ESR2CTSB
SCHEMBL18079679 0.80 SLC7A5 (0.43) TAAR1SLC6A2ESR1ESR2ACE
SCHEMBL17135385 0.80 SLC7A5 (0.43) TAAR1SLC6A2ESR1ESR2ACE
SCHEMBL23845056 0.79 CYP3A4 (0.40) TAAR1ACECTSBMAPTCYP1A2
SCHEMBL8593961 0.79 SLC7A5 (0.46) TAAR1SLC6A2ESR1ESR2ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200190178-A1 ANTIBODIES SPECIFIC FOR HYPERPHOSPHORYLATED TAU AND METHODS OF USE THEREOF H. LUNDBECK A/S (DK) 2020-06-18 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-20200190178-A1 ANTIBODIES SPECIFIC FOR HYPERPHOSPHORYLATED TAU AND METHODS OF USE THEREOF MAPT, PSEN2, PSEN1 TAAR1 3938/4885SLC6A2 1701/4885ESR1 4716/4885

“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.