SCHEMBL10105022

SCHEMBL10105022

C=C(C)C(=O)OCC(O)COC(=O)C1CCC(C(=O)O)CC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34

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
SCHEMBL12192387 0.83 TSHR (0.45) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL17531104 0.83 THRB (0.42) TSHRALDH1A1
SCHEMBL10101381 0.83 TSHR (0.35) TSHRALDH1A1
SCHEMBL3408548 0.83 TSHR (0.50) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL17531129 0.79 THRB (0.44) TSHRALDH1A1
SCHEMBL3408551 0.77 TSHR (0.44) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL23369734 0.76 ADRB2 (0.54) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL25647264 0.76 ADRB2 (0.54) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL14505066 0.75 TSHR (0.40) TSHRALDH1A1ADRB2ADRB1ADRB3
SCHEMBL1297661 0.75 RAB9A (0.42) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8557948-B2 Photosensitive composition, photosensitive film, photosensitive laminate, method of forming a permanent pattern, and printed board FUJIFILM CORPORATION (JP) 2013-10-15 US disclosed
US-20120048594-A1 PHOTOSENSITIVE COMPOSITION, PHOTOSENSITIVE FILM, PHOTOSENSITIVE LAMINATE, METHOD OF FORMING A PERMANENT PATTERN, AND PRINTED BOARD FUJIFILM CORPORATION (JP) 2012-03-01 US disclosed