SCHEMBL27396997

SCHEMBL27396997

NCCCOS(=O)(=S)OCCCN

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 15/20 0.42
CA2 P00918 15/20 0.42
CA9 Q16790 13/20 0.42
CA12 O43570 3/20 0.40
CA3 P07451 3/20 0.40
CA4 P22748 3/20 0.40
CA6 P23280 3/20 0.40
CA5A P35218 3/20 0.40
CA7 P43166 3/20 0.40
CA14 Q9ULX7 3/20 0.40
CA5B Q9Y2D0 3/20 0.40
ODC1 P11926 1/20 0.39
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
APP P05067 1/20 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
SCHEMBL27957429 0.92 CA1 (0.46) CA1CA2CA9CA12CA3
SCHEMBL28111037 0.90 CA1 (0.48) CA1CA2CA9CA12CA3
SCHEMBL7105445 0.83 CA1 (0.33) CA1CA2CA9CA12CA3
SCHEMBL1279310 0.82
SCHEMBL8506764 0.78 CA1 (0.46) CA1CA2CA9CA12CA3
SCHEMBL15709128 0.75 CA1 (0.44) CA1CA2CA9CA12CA3
SCHEMBL10490995 0.74
SCHEMBL16230093 0.74
SCHEMBL5424137 0.74
SCHEMBL27916330 0.74 CA1 (0.58) CA1CA2CA9CA12CA3

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-114891282-A Support rubber composition for run-flat tire, mixing method thereof and tire 中策橡胶集团股份有限公司 2022-08-12 CN disclosed
CN-109563318-A Rubber blend, sulfur-crosslinkable rubber mixture and vehicle tire 大陆轮胎德国有限公司 2019-04-02 CN disclosed
CN-103570978-B Rubber composition for tire and pneumatic tire 住友橡胶工业株式会社 2016-12-28 CN disclosed
CN-103717649-A Method for lowering dynamic-to-static modulus ratio of vulcanized rubber SUMITOMO CHEMICAL CO 2014-04-09 CN disclosed
CN-103570978-A Rubber composition used for tyre and pneumatic tyre SUMITOMO RUBBER IND 2014-02-12 CN disclosed
CN-1088703-C Water soluble taxad alcohol derivative QI YOUMAO (CN) 2002-08-07 CN disclosed
CN-1288890-A Water soluble taxad alcohol derivative QI YOUMAO (CN) 2001-03-28 CN disclosed