SCHEMBL9845773

SCHEMBL9845773

FC(F)(F)C1CC=C(Cl)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
CES2 O00748 2/20 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
SCHEMBL13726989 0.78 LMNA (0.42) LMNACES2
SCHEMBL9392982 0.75 CES2 (0.47) LMNACES2
SCHEMBL13370662 0.74 NOS3 (0.35) LMNACES2
SCHEMBL13248079 0.74 LMNA (0.62) LMNACES2
SCHEMBL12519550 0.74 LMNA (0.38) LMNACES2
SCHEMBL24783009 0.71 LMNA (0.40) LMNACES2
SCHEMBL12603760 0.71 TRPV3 (0.38) LMNACES2
SCHEMBL9392951 0.71 DRD3 (0.44) LMNACES2
SCHEMBL16647717 0.69 CES2 (0.47) LMNACES2
SCHEMBL14731964 0.69 CES2 (0.66) LMNACES2

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-0417690-A2 Aromatization process OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-20 EP claimed
US-4968830-A HALOGENATIVE DEHYDROGENATION OCCIDENTAL CHEMICAL CORPORATION (US) 1990-11-06 US claimed
EP-0417690-A2 Aromatization process OCCIDENTAL CHEMICAL CORPORATION (US) 1991-03-20 EP disclosed
US-4968830-A HALOGENATIVE DEHYDROGENATION OCCIDENTAL CHEMICAL CORPORATION (US) 1990-11-06 US disclosed