SCHEMBL31443215

SCHEMBL31443215

C=COC(=O)CC.CCCCOC(=O)CC

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.60
TSHR P16473 4/20 0.53
HPGD P15428 1/20 0.53
ATM Q13315 1/20 0.47
ALDH1A1 P00352 1/20 0.45
HCAR2 Q8TDS4 1/20 0.42
HTT P42858 1/20 0.41
DGKA P23743 1/20 0.41
RAD52 P43351 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FAAH O00519 1/20 0.39
DNM1 Q05193 1/20 0.39
ESR1 P03372 1/20 0.38
HTR2C P28335 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
SCHEMBL31443222 0.85 TSHR (0.61) NAAATSHRHPGDATMALDH1A1
Formaldehyde SCHEMBL28029672 0.84 NAAA (0.75) NAAATSHRHPGDATMALDH1A1
SCHEMBL28562463 0.84 NAAA (0.82) NAAATSHRHPGDATMALDH1A1
SCHEMBL26794 0.84
SCHEMBL27954430 0.84 TSHR (0.59) NAAATSHRHPGDATMALDH1A1
Ammonia Solution, Strong SCHEMBL23711256 0.82 NAAA (0.78) NAAATSHRHPGDATMALDH1A1
Water SCHEMBL27611718 0.82 NAAA (0.78) NAAATSHRHPGDATMALDH1A1
Ethane SCHEMBL28195545 0.82 NAAA (0.78) NAAATSHRHPGDATMALDH1A1
Fluoride SCHEMBL27853779 0.82 NAAA (0.78) NAAATSHRHPGDATMALDH1A1
Hydrochloric Acid SCHEMBL28177992 0.82 NAAA (0.78) NAAATSHRHPGDATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119591771-A Organic polymer carrier, Z-N catalyst, and preparation method and application thereof 中国石油天然气股份有限公司 2025-03-11 CN claimed