SCHEMBL17599201

SCHEMBL17599201

O=C1NCCN1CCCS

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
POLB P06746 3/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
RET P07949 1/20 0.38
KDR P35968 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL17599196 0.94 ALDH1A1 (0.41) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL17599187 0.88 SMN1; SMN2 (0.44) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL11593402 0.87
SCHEMBL7261352 0.87 ALDH1A1 (0.47) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL13843636 0.87 ALDH1A1 (0.47) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL11173610 0.85 ALDH1A1 (0.46) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL2118226 0.85 ALDH1A1 (0.46) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL17599189 0.82 SMN1; SMN2 (0.42) ALDH1A1POLBKMT2ARAB9AKDM4E
SCHEMBL13236669 0.82 ALDH1A1 (0.50) ALDH1A1POLBKMT2AMEN1RAB9A
SCHEMBL1446116 0.81 ALDH1A1 (0.43) ALDH1A1POLBKMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213333-B Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2024-06-25 CN disclosed
CN-111315719-B Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2022-12-27 CN disclosed
CN-114276298-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2022-04-05 CN disclosed
EP-2998327-B1 POLYOLEFIN MODIFIED WITH NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AND ADHESIVE COMPOSITION CONTAINING SAME TOYO BOSEKI (JP) 2022-03-23 EP disclosed
CN-114213333-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2022-03-22 CN disclosed
CN-111315719-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2020-06-19 CN disclosed
US-10253114-B2 Polyolefin modified with nitrogen-containing heterocyclic compound, and adhesive composition containing same TOYOBO CO., LTD. (JP) 2019-04-09 US disclosed
US-20160130373-A1 POLYOLEFIN MODIFIED WITH NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AND ADHESIVE COMPOSITION CONTAINING SAME TOYOBO CO., LTD. (JP) 2016-05-12 US disclosed
EP-2998327-A1 POLYOLEFIN MODIFIED WITH NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AND ADHESIVE COMPOSITION CONTAINING SAME TOYOBO CO., LTD. (JP) 2016-03-23 EP disclosed