SCHEMBL29704034

SCHEMBL29704034

C[Si](C)(C)OP(=O)(O)OCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.70
▸ CETP P11597 3/20 0.50
▸ SRC P12931 1/20 0.50
▸ FOLH1 Q04609 1/20 0.44
▸ PDPK1 O15530 2/20 0.42
▸ MTOR P42345 1/20 0.42
▸ AKR1C3 P42330 1/20 0.42
▸ ALPG P10696 1/20 0.42
▸ PTK2B Q14289 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ FUCA1 P04066 1/20 0.40
▸ MAOB P27338 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL27908642 0.83 TSHR (1.00) TSHRCETPSRCFOLH1PDPK1
SCHEMBL51316 0.83 TSHR (1.00) TSHRCETPSRCFOLH1PDPK1
SCHEMBL9446520 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
Hydrochloric Acid SCHEMBL10722992 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
SCHEMBL4219700 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
Ammonia Solution, Strong SCHEMBL7268743 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
Phosphoric Acid SCHEMBL27741297 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
SCHEMBL11756554 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
SCHEMBL28264490 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1
SCHEMBL28032525 0.81 TSHR (0.96) TSHRCETPSRCFOLH1PDPK1

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-114616225-A Treprostinil prodrugs 联合治疗公司 2022-06-10 — — CN disclosed
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