SCHEMBL8520641

SCHEMBL8520641

C=C(C)C(=O)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(C)F

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL15921891 1.00 TSHR (0.34) TSHRALDH1A1
SCHEMBL16504610 1.00 TSHR (0.34) TSHRALDH1A1
SCHEMBL437657 1.00 TSHR (0.34) TSHRALDH1A1
SCHEMBL18260684 1.00 TSHR (0.34) TSHRALDH1A1
SCHEMBL1667267 1.00 TSHR (0.34) TSHRALDH1A1
SCHEMBL2318292 0.98 TSHR (0.35) TSHRALDH1A1
SCHEMBL2784243 0.93 TSHR (0.36) TSHRALDH1A1
Valine SCHEMBL8573457 0.89 SLC7A5 (0.40)
SCHEMBL15157568 0.88 GAA (0.38) TSHRALDH1A1
SCHEMBL8467259 0.88 GAA (0.38) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5998084-A RADIATION-SENSITIVE 1,2-NAPHTHOQUINONE-2-DIAZIDE-4- OR -5-SULFONIC ACID ESTER OF A POLYCONDENSATE HAVING PHENOLIC HYDROXY GROUPS; NOVOLAK; VINYL POLYMER COMPRISING AT LEAST ONE UNIT HAVING A LATERAL HYDROXYPHENYL GROUP, CLATHRATE AGFA-GEVAERT N.V. (BE) 1999-12-07 US disclosed
EP-0774692-B1 Radiation-sensitive recording material for the production of planographic printing plates AGFA GEVAERT AG (DE) 1999-09-29 EP disclosed
EP-0774692-A2 Radiation-sensitive recording material for the production of planographic printing plates HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-21 EP disclosed