SCHEMBL28388990

SCHEMBL28388990

CCN(CC)C1CCCCCCCCCCCCCCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 5/20 0.50
ADH1C P00326 3/20 0.50
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
TMEM97 Q5BJF2 1/20 0.37
EBP Q15125 1/20 0.37
PHGDH O43175 1/20 0.37
HPGD P15428 1/20 0.36
SHBG P04278 1/20 0.36
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35
CYP1A2 P05177 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
SCHEMBL356022 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
SCHEMBL611858 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
SCHEMBL613463 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
SCHEMBL612572 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
SCHEMBL150343 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
SCHEMBL23073672 1.00 ADH1A (0.50) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
Fluoride SCHEMBL9620456 0.97 ADH1A (0.48) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
Water SCHEMBL29014909 0.97 ADH1A (0.48) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL2142268 0.97 ADH1A (0.48) ADH1AADH1CALDH1A1SMN1; SMN2MEN1
Phosphine SCHEMBL27880090 0.97 ADH1A (0.48) ADH1AADH1CALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120004763-A Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof KS试验研究株式会社 2025-05-16 CN disclosed
CN-116018336-B Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof KS试验研究株式会社 2025-02-18 CN disclosed
CN-119306631-A Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof KS试验研究株式会社 2025-01-14 CN disclosed
CN-119306632-A Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof KS试验研究株式会社 2025-01-14 CN disclosed
CN-118591525-A Preparation method of ester thiol compound and optical resin comprising same KS光学株式会社 2024-09-03 CN disclosed
CN-113874413-B Polymerizable composition and optical material using same SKC株式会社 2024-01-02 CN disclosed
CN-116018336-A Process for the preparation of isocyanate compounds comprising non-chlorinated derivatives and compositions thereof KS试验研究株式会社 2023-04-25 CN disclosed
CN-113874413-A Polymerizable composition and optical material using same SKC株式会社 2021-12-31 CN disclosed
CN-112004797-A Process for preparing polythiols having improved storage stability SKC株式会社 2020-11-27 CN disclosed
CN-107810178-B Method for producing 3-mercaptopropionic acid, and method for producing carboxylate compound having mercapto group and thiourethane optical material using the same 可奥熙搜路司有限公司 2020-04-28 CN disclosed