SCHEMBL8944715

SCHEMBL8944715

CC(C)(COC(=O)/C=C/C(=O)O)COC(=O)c1ccccc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.47
▸ HCAR2 Q8TDS4 6/20 0.47
▸ TSHR P16473 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7640224 0.81 HCAR2 (0.62) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL10417831 0.81 HCAR2 (0.62) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL9723920 0.80 ALDH1A1 (0.54) ALDH1A1TSHRL3MBTL1CYP3A4LMNA
SCHEMBL11007649 0.79 SERPINE1 (0.43) ALDH1A1HCAR2MAPTSMN1; SMN2CYP3A4
SCHEMBL8944708 0.79 SERPINE1 (0.43) ALDH1A1HCAR2MAPTSMN1; SMN2CYP3A4
Phthalic Acid SCHEMBL11481696 0.78 HCAR2 (0.67) ALDH1A1HCAR2TSHRKDM4EMAPT
Phthalic Acid SCHEMBL11481694 0.78 HCAR2 (0.67) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL10894107 0.78 HCAR2 (0.57) ALDH1A1HCAR2TSHRKDM4EMAPT
SCHEMBL7633775 0.78 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10L3MBTL1CYP3A4
SCHEMBL28690056 0.76 ALDH1A1 (0.57) ALDH1A1TSHRKDM4EHPGDSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5545679-A CURRENT LIMITERS, RESETTABLE FUSES EATON CORPORATION (US) 1996-08-13 — — US claimed
US-5545679-A CURRENT LIMITERS, RESETTABLE FUSES EATON CORPORATION (US) 1996-08-13 — — US disclosed
US-5545679-A CURRENT LIMITERS, RESETTABLE FUSES EATON CORPORATION (US) 1996-08-13 — — US disclosed
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