SCHEMBL30851191

SCHEMBL30851191

O=C1OC(=O)c2cc(C(F)(F)F)c(-c3cc4c(cc3C(F)(F)F)C(=O)OC4=O)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GLA P06280 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ PSMB8 P28062 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ CES1 P23141 1/20 0.32
▸ TYMS P04818 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ CFTR P13569 1/20 0.31
▸ AR P10275 3/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.31
▸ C1R P00736 1/20 0.30
▸ KMO O15229 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
SCHEMBL17915436 1.00 ALOX15 (0.39) ALOX15TDP1GLAPOLBGAA
SCHEMBL22070109 0.91 ALOX15 (0.42) ALOX15TDP1GLAPOLBGAA
SCHEMBL17914269 0.89 TRPA1 (0.34) ALOX15TDP1NOTUMARCYP1A2
SCHEMBL21082291 0.83 CYP3A4 (0.41) GAAALDH1A1ARCYP3A4
SCHEMBL29077086 0.81 NOTUM (0.36) ALOX15TDP1ALDH1A1PSMB8NOTUM
SCHEMBL18180028 0.80 TRPA1 (0.30) —
SCHEMBL3993249 0.77 TDP1 (0.59) ALOX15TDP1TSHRALDH1A1TYMS
SCHEMBL27085505 0.77 TYMS (0.51) ALOX15TDP1GLAPOLBGAA
SCHEMBL8187156 0.76 CFTR (0.41) TYMSCFTRKMO
SCHEMBL13903365 0.71 ALOX15 (0.42) ALOX15TDP1POLBTSHRALDH1A1

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
CN-117777581-B High temperature resistant PE packaging film 建德市广鑫塑业有限公司 2024-11-22 — — CN disclosed
CN-118727449-A High-temperature-resistant polyimide water-based carbon fiber sizing agent and preparation method thereof 黑龙江省科学院石油化学研究院 2024-10-01 — — CN disclosed
CN-117777581-A High temperature resistant PE packaging film 建德市广鑫塑业有限公司 2024-03-29 — — CN disclosed
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