SCHEMBL19477879

SCHEMBL19477879

CN[C@@H](Cc1ccc(O)cc1)C(=O)NCCO

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ GRIA1 P42261 6/20 0.49
▸ CHRND Q07001 5/20 0.48
▸ CHRNA1 P02708 1/20 0.48
▸ CHRNG P07510 1/20 0.48
▸ CHRNB1 P11230 1/20 0.48
▸ CTSL P07711 1/20 0.46

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
SCHEMBL19477907 0.88 CHRND (0.54) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL22175312 0.86 CYP3A4 (0.68) CYP3A4TSHRCTSL
SCHEMBL19477908 0.85 CHRND (0.61) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL22461945 0.84 CHRND (0.47) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL15359366 0.84 GRIA1 (0.46) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL7029376 0.82 MMP1 (0.51) CTSL
SCHEMBL8022821 0.82 MMP1 (0.51) CTSL
SCHEMBL16656679 0.82 GRIA1 (0.46) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL16217709 0.82 GRIA1 (0.46) GRIA1CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL21415384 0.82 GRIA1 (0.46) GRIA1CHRNDCHRNA1CHRNGCHRNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021081420-A2 CONJUGATES AND METHODS FOR TREATING ACROMEGALY GENEVANT SCIENCES GMBH (CH) 2021-04-29 — — WO disclosed
WO-2020191207-A1 THERAPEUTIC METHODS FOR TREATING HEPATITIS B ARBUTUS BIOPHARMA CORPORATION (CA) 2020-09-24 — — WO disclosed
WO-2019051257-A2 METHODS FOR TREATING HEPATITIS B INFECTIONS ARBUTUS BIOPHARMA CORPORATION (CA) 2019-03-14 — — WO disclosed
WO-2017177326-A1 TARGETED NUCLEIC ACID CONJUGATE COMPOSITIONS PROTIVA BIOTHERAPEUTICS, INC. (CA) 2017-10-19 — — WO disclosed
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