SCHEMBL7651703

SCHEMBL7651703

O=C(OOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
USP2 O75604 1/20 0.32
MAPT P10636 1/20 0.32
GAA P10253 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
SCHEMBL2867300 0.93 TSHR (0.42) TSHRKDM4ETDP1USP2MAPT
SCHEMBL3482344 0.91 TSHR (0.41) TSHRKDM4ETDP1USP2MAPT
SCHEMBL345645 0.91 TSHR (0.41) TSHRKDM4ETDP1USP2MAPT
SCHEMBL346911 0.91 TSHR (0.41) TSHRKDM4ETDP1USP2MAPT
SCHEMBL818109 0.91 TSHR (0.41) TSHRKDM4ETDP1USP2MAPT
SCHEMBL22142455 0.86 TSHR (0.43) TSHRKDM4ETDP1USP2MAPT
SCHEMBL345647 0.86 THRB (0.39) TSHRKDM4ETDP1USP2MAPT
SCHEMBL10622476 0.85 TSHR (0.37) TSHRKDM4ETDP1USP2MAPT
SCHEMBL146689 0.84 TSHR (0.42) TSHRKDM4ETDP1USP2MAPT
SCHEMBL29362926 0.82 ALDH1A1 (0.30) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6491903-B1 NARROW MOLECULAR WEIGHT DISTRIBUTION SHELL-CORE POLYMERS HAVING HYDROPHILIC, CROSSLINKED PERMEABLE SHELLS AND HYDROPHOBIC CORES, USED FOR REDUCING BLOOD CHOLESTEROL AND BILE ACID UPTAKE IN INTERSTINES; DRUG DELIVERY WASHINGTON UNIVERSITY 2002-12-10 US disclosed
US-6383500-B1 Particles comprising amphiphilic copolymers, having a crosslinked shell domain and an interior core domain, useful for pharmaceutical and other applications WASHINGTON UNIVERSITY 2002-05-07 US disclosed
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed
US-4155953-A Process for production of modified polychlorotrifluoroethylene DAIKIN KOGYO CO., LTD. (JP) 1979-05-22 US disclosed