SCHEMBL8459110

SCHEMBL8459110

Fc1c(F)c(F)c(C(F)(F)F)c(Cl)c1F

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.34
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7951376 0.92 NOTUM (0.33) NOTUM
SCHEMBL7959691 0.86 NOTUM (0.33) NOTUM
SCHEMBL7069317 0.86 TSHR (0.33) NOTUMTSHRSMN1; SMN2
SCHEMBL28517192 0.85 NOTUM (0.36) NOTUMTSHRSMN1; SMN2
SCHEMBL312356 0.77 SMN1; SMN2 (0.36) TSHRSMN1; SMN2
Perfluorotoluene SCHEMBL308464 0.77 SMN1; SMN2 (0.41) TSHRSMN1; SMN2
SCHEMBL11267899 0.77 NOTUM (0.34) NOTUM
SCHEMBL11264290 0.74 NOTUM (0.33) NOTUM
SCHEMBL11131665 0.74 NOTUM (0.31) NOTUM
SCHEMBL11131459 0.74 TSHR (0.32) NOTUMTSHRSMN1; SMN2

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-0781747-B1 Process for the preparation of 2,3,4,5-tetrafluoro-benzotrifluoride BAYER AG (DE) 1999-09-01 EP disclosed
EP-0023647-B1 Process for the preparation of halogenated benzoyl fluorides BAYER AG (DE) 1982-06-30 EP disclosed
US-4330366-A Process for the preparation of halogenated benzoyl fluorides BAYER AKTIENGESELLSCHAFT (DE) 1982-05-18 US disclosed
EP-0023647-A1 Process for the preparation of halogenated benzoyl fluorides BAYER AG (DE) 1981-02-11 EP disclosed