SCHEMBL6322919

SCHEMBL6322919

C[Si](C)(Cl)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
KCNN4 O15554 5/20 0.39
MAPK1 P28482 2/20 0.39
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ALOX15 P16050 1/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 2/20 0.34
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL6324964 0.84 TSHR (0.43) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL6321916 0.78 TSHR (0.48) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL7053156 0.77 ALDH1A1 (0.44) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL6602963 0.74 ALDH1A1 (0.39) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL6860477 0.74 ALDH1A1 (0.43) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL10332646 0.74 KCNN4 (0.39) TSHRKCNN4MAPK1ALDH1A1TAAR1
SCHEMBL6602971 0.74 ALDH1A1 (0.41) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL3743994 0.74 KCNN4 (0.39) TSHRKCNN4MAPK1ALDH1A1TAAR1
SCHEMBL10332647 0.74 KCNN4 (0.43) TSHRKCNN4MAPK1ALDH1A1CYP1A2
SCHEMBL10633132 0.72 MAPK1 (0.42) TSHRKCNN4MAPK1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112794858-B Preparation method of compound with 3,4-trans-3, 6-anhydro-hexofuranose structure 中国药科大学 2021-06-25 CN claimed
CN-112794858-A Preparation method of compound with 3,4-trans-3, 6-anhydro-hexofuranose structure 中国药科大学 2021-05-14 CN claimed
CN-112794858-B Preparation method of compound with 3,4-trans-3, 6-anhydro-hexofuranose structure 中国药科大学 2021-06-25 CN disclosed
CN-112794858-A Preparation method of compound with 3,4-trans-3, 6-anhydro-hexofuranose structure 中国药科大学 2021-05-14 CN disclosed
US-20050118742-A1 Method for reducing the adhesive properties of MEMS and anti-adhesion-coated device ROBERT BOSCH GMBH (DE) 2005-06-02 US disclosed
US-4889941-A Synthetic flavonoids as inhibitors of leukotrienes and 5-lipoxygenase FISONS CORPORATION (US) 1989-12-26 US disclosed
EP-0288077-A2 Synthetic flavonoids as inhibitors of leukotrienes and 5-lipoxygenase PENNWALT CORPORATION (US) 1988-10-26 EP disclosed