SCHEMBL29018347

SCHEMBL29018347

C=C(C)C(=O)OC(C(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 3/20 0.37
THRB P10828 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
ELANE P08246 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL7248651 0.82 ALDH1A1 (0.48) ALDH1A1TSHRTHRBTDP1HSD17B10
Methacrylic Acid SCHEMBL28670045 0.80 TSHR (0.49) ALDH1A1TSHRTHRBTDP1
SCHEMBL8551289 0.78 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1ELANE
SCHEMBL2608062 0.78 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1ELANE
SCHEMBL27984736 0.76 ALDH1A1 (0.42) ALDH1A1TSHRTHRBTDP1ELANE
SCHEMBL17070899 0.76 ALDH1A1 (0.52) ALDH1A1TSHRTHRBTDP1ELANE
SCHEMBL29028414 0.75
SCHEMBL12354768 0.75 ALDH1A1 (0.41) ALDH1A1TSHRTHRBELANE
SCHEMBL27873184 0.75 ALDH1A1 (0.41) ALDH1A1TSHRTHRBELANE
SCHEMBL33412 0.74 ALDH1A1 (0.50) ALDH1A1TSHRTHRBTDP1ELANE

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-116355448-A Low-surface-energy self-sealing gradient radar wave-absorbing coating and application method thereof 电子科技大学 2023-06-30 CN disclosed
CN-116278290-A Multilayer composite polycaprolactone board and preparation method and application thereof 广东美岑医疗设备有限公司 2023-06-23 CN disclosed