SCHEMBL8663289

SCHEMBL8663289

NN(C(=O)c1ccccc1)C(=O)c1ccccc1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
KDM4E B2RXH2 8/20 0.50
HPGD P15428 6/20 0.50
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
HMGB1 P09429 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
CA14 Q9ULX7 1/20 0.50
MAPT P10636 3/20 0.48
HSD17B10 Q99714 3/20 0.48
CYP3A4 P08684 1/20 0.47
GAA P10253 2/20 0.44
GSTA1 P08263 1/20 0.44

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
SCHEMBL750649 0.90 KDM4E (0.58) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
Oxalic Acid SCHEMBL23496612 0.89 HPGD (0.54) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL11790045 0.85 TSHR (0.58) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL64274 0.84 TDP1 (0.52) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL11328033 0.82 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL549420 0.82 KDM4E (0.54) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
Adipic Acid SCHEMBL23496613 0.81 TSHR (0.50) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL20957602 0.80 TSHR (0.51) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL7905011 0.80 TSHR (0.49) TSHRKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL7173445 0.79 KDM4E (0.50) TSHRKDM4EHPGDALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104829487-B Assemble ammonia sensitized metal-organogel Composite soft material material and the preparation thereof of luminescence enhancement 福州大学 2016-09-07 CN claimed
CN-104829487-A Aggregation luminescence enhancement ammonia sensitive metal-organic gel compound soft material and preparation thereof UNIV FUZHOU 2015-08-12 CN claimed
US-3994987-A Metal deactivators as adhesion promotors for vulcanizable elastomers to metals CIBA-GEIGY CORPORATION (US) 1976-11-30 US claimed
CN-104829487-B Assemble ammonia sensitized metal-organogel Composite soft material material and the preparation thereof of luminescence enhancement 福州大学 2016-09-07 CN disclosed
CN-104829487-B Assemble ammonia sensitized metal-organogel Composite soft material material and the preparation thereof of luminescence enhancement 福州大学 2016-09-07 CN disclosed
CN-104829487-A Aggregation luminescence enhancement ammonia sensitive metal-organic gel compound soft material and preparation thereof UNIV FUZHOU 2015-08-12 CN disclosed
CN-104829487-A Aggregation luminescence enhancement ammonia sensitive metal-organic gel compound soft material and preparation thereof UNIV FUZHOU 2015-08-12 CN disclosed
EP-0879855-A1 THERMOPLASTIC RESIN COMPOSITION AND FILM MADE FROM THE COMPOSITION Mitsui Chemicals, Inc. (JP) 1998-11-25 EP disclosed