SCHEMBL10353039

SCHEMBL10353039

CC(=O)N1CCC(=O)Sc2ccc(Cl)cc21

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 8/20 0.61
HSD17B3 P37058 4/20 0.51
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
TRIM24 O15164 1/20 0.41
AVPR1A P37288 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL10352927 0.80 NOTUM (0.60) NOTUMHSD17B3POLB
SCHEMBL5793078 0.76 NOTUM (1.00) NOTUMHSD17B3ALDH1A1LMNAKMT2A
SCHEMBL5795715 0.76 NOTUM (1.00) NOTUMHSD17B3ALDH1A1LMNAKMT2A
SCHEMBL5009163 0.73 NOTUM (1.00) NOTUMHSD17B3MAPTPOLBTRIM24
SCHEMBL11147651 0.72 NOTUM (0.66) NOTUMHSD17B3MAPTPOLBTRIM24
SCHEMBL28984695 0.67 NOTUM (0.60) NOTUMHSD17B3MAPTAVPR1A
SCHEMBL8870414 0.67 NOX1 (0.73) MAPTMEN1ALDH1A1LMNAKMT2A
SCHEMBL10353391 0.67 LMNA (0.57) NOTUMHSD17B3MAPTMEN1ALDH1A1
SCHEMBL11142890 0.67 NOTUM (0.61) NOTUMHSD17B3MAPTPOLBTRIM24
SCHEMBL11142887 0.67 NOTUM (0.61) NOTUMHSD17B3MAPTPOLBTRIM24

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
EP-0292824-B1 PROCESS FOR THE NUCLEAR CHLORINATION OF AROMATIC HYDROCARBONS BAYER AG (DE) 1990-08-01 EP disclosed
US-4851596-A Process for nucleus-chlorination of aromatic hydrocarbons BAYER AKTIENGESELLSCHAFT (DE) 1989-07-25 US disclosed
EP-0292824-A1 Process for the nuclear chlorination of aromatic hydrocarbons BAYER AG (DE) 1988-11-30 EP disclosed