SCHEMBL9560516

SCHEMBL9560516

Nc1c(F)c(F)c(C(F)(F)F)c(F)c1Cl

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.32
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9747850 0.90 NOTUM (0.33) NOTUM
SCHEMBL27044712 0.82
SCHEMBL1639619 0.82 SMN1; SMN2 (0.35) TSHRSMN1; SMN2
SCHEMBL7868555 0.79 SMN1; SMN2 (0.34) TSHRSMN1; SMN2
SCHEMBL24227302 0.77 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL8942951 0.77 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL7069317 0.77 TSHR (0.33) NOTUMTSHRSMN1; SMN2
SCHEMBL1322693 0.76 NOTUM (0.36) NOTUMTSHRSMN1; SMN2
SCHEMBL28517192 0.76 NOTUM (0.36) NOTUMTSHRSMN1; SMN2
SCHEMBL26890855 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0315863-B1 Trifluoromethylamino benzenes containing fluorine, and their preparation BAYER AG (DE) 1993-11-18 EP disclosed
US-5082971-A TRIFLUOROMETHYLAMINOBENZENES CONTAINING FLUORINE AND/OR CHLORINE AND THEIR PREPARATION BAYER AKTIENGESELLSCHAFT (DE) 1992-01-21 US disclosed