SCHEMBL27433561

SCHEMBL27433561

C=C(C=C(C)C(=O)O)C(=O)OCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL7122525 0.91 TSHR (0.60) TSHRALDH1A1
SCHEMBL6130512 0.88 TSHR (0.42) TSHR
SCHEMBL3993520 0.82 KDM4E (0.36) TSHRALDH1A1HPGD
SCHEMBL432150 0.80 NPSR1 (0.42) TSHRALDH1A1CYP2D6CYP2C19
Ammonia Solution, Strong SCHEMBL15128898 0.79 NPSR1 (0.41) TSHRALDH1A1CYP2D6CYP2C19
SCHEMBL7104033 0.79 TSHR (0.41) TSHRALDH1A1
SCHEMBL29098944 0.78 TSHR (0.46) TSHRRAB9AALDH1A1
SCHEMBL610540 0.77 TSHR (0.38) TSHR
SCHEMBL663891 0.77 TSHR (0.35) TSHR
Methacrylic Acid SCHEMBL9069461 0.77 NPSR1 (0.40) TSHRALDH1A1CYP2D6CYP2C19

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
CN-1123040-C Method and device for mfg. plasma display TORAY INDUSTRIES (JP) 2003-10-01 CN disclosed
CN-1216149-A Method and device for mfg. plasma display TORAY INDUSTRIES (JP) 1999-05-05 CN disclosed