SCHEMBL16174643

SCHEMBL16174643

C=C(C#N)C(=O)OC(CCCC)CCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
ALDH1A1 P00352 1/20 0.46
CA2 P00918 1/20 0.38
GPR84 Q9NQS5 7/20 0.36
FFAR1 O14842 1/20 0.36
MAPT P10636 2/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
MAPK1 P28482 1/20 0.36
LCK P06239 1/20 0.35
PPARD Q03181 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
FAAH O00519 1/20 0.35
LMNA P02545 2/20 0.34

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
SCHEMBL3183024 0.92 TSHR (0.47) TSHRALDH1A1CA2MAPTMAPK1
SCHEMBL819755 0.91 TSHR (0.46) TSHRALDH1A1GPR84FFAR1MAPT
SCHEMBL15520525 0.89 TSHR (0.47) TSHRALDH1A1CA2MAPK1LMNA
SCHEMBL26675834 0.87 TSHR (0.42) TSHRALDH1A1GPR84FFAR1MAPT
SCHEMBL3141579 0.86 TSHR (0.47) TSHRALDH1A1CA2GPR84FFAR1
SCHEMBL15519449 0.85 ALDH1A1 (0.53) TSHRALDH1A1
SCHEMBL9337195 0.84 TSHR (0.46) TSHRALDH1A1GPR84FFAR1MAPT
2-Octyl Cyanoacrylate SCHEMBL24588 0.84 FAAH (0.48) TSHRALDH1A1GPR84MAPTFAAH
SCHEMBL17142023 0.84 FAAH (0.48) TSHRALDH1A1GPR84MAPTFAAH
SCHEMBL16174676 0.84 TSHR (0.46) TSHRALDH1A1GPR84FFAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2792372-B1 BIODEGRADABLE MEDICAL ADHESIVE AND PREPARATION METHOD AND USE THEREOF INST PHARMACOLOGY & TOXICOLOGY ACADEMY MILITARY MEDICAL SCIENCES PLA CHINA (CN) 2018-07-25 EP disclosed
US-9750841-B2 Biodegradable medical adhesive and preparation method and use thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. (CN) 2017-09-05 US disclosed
US-20140369952-A1 BIODEGRADABLE MEDICAL ADHESIVE AND PREPARATION METHOD AND USE THEREOF CHENGDU YIPING MEDICAL SCIENCE & TECHNOLOGY CO., LTD. (CN) 2014-12-18 US disclosed
EP-2792372-A1 BIODEGRADABLE MEDICAL ADHESIVE AND PREPARATION METHOD AND USE THEREOF Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2014-10-22 EP disclosed