SCHEMBL30596201

SCHEMBL30596201

C[P+](C)(C)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.45
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
ALOX12 P18054 2/20 0.39
ACHE P22303 1/20 0.39
TAAR1 Q96RJ0 6/20 0.38
SLC6A2 P23975 2/20 0.38
MAOA P21397 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CYP2A6 P11509 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
ADRA2A P08913 1/20 0.36
ADRA2C P18825 1/20 0.36
CYP2D6 P10635 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 2/20 0.35

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
Fluoride Ion SCHEMBL1961963 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
Hydrochloric Acid SCHEMBL5085115 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
Iodide SCHEMBL5087524 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
SCHEMBL9752186 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
Bromide SCHEMBL2355315 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
Water SCHEMBL1067231 0.97 HIF1A (0.43) HIF1ATDP1LMNATSHRALOX12
SCHEMBL7877206 0.94 HIF1A (0.41) HIF1ATDP1LMNATSHRALOX12
SCHEMBL7872878 0.86 HIF1A (0.42) HIF1ALMNATSHRTAAR1SLC6A2
Phenol SCHEMBL7874538 0.86 HIF1A (0.36) HIF1ATDP1LMNATSHRALOX12
Sulfuric Acid SCHEMBL7643758 0.84 CA12 (0.36) HIF1ATDP1LMNATSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840583-B2 Thermally stable, dispersible cellulose nanocrystals AMERICAN UNIVERSITY (US) 2023-12-12 US claimed
CN-112180705-B Electrophotographic belt and electrophotographic image forming apparatus 佳能株式会社 2024-06-14 CN disclosed
US-11840583-B2 Thermally stable, dispersible cellulose nanocrystals AMERICAN UNIVERSITY (US) 2023-12-12 US disclosed
US-11813883-B2 Electrophotographic member and electrophotographic image forming apparatus CANON KABUSHIKI KAISHA (JP) 2023-11-14 US disclosed