SCHEMBL7861796

SCHEMBL7861796

CONC(C)c1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TP53 P04637 2/20 0.53
HTT P42858 1/20 0.53
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RAB9A P51151 1/20 0.39
IDO1 P14902 1/20 0.39
TDO2 P48775 1/20 0.39
HTR2A P28223 3/20 0.39
SLC6A4 P31645 3/20 0.39
KCNH2 Q12809 3/20 0.39
P2RX7 Q99572 1/20 0.38

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
SCHEMBL8210156 0.80 LMNA (0.67) LMNATP53HTTMEN1KMT2A
SCHEMBL2982000 0.80 LMNA (0.61) LMNATP53HTTMEN1KMT2A
SCHEMBL19965517 0.79 LMNA (0.59) LMNATP53HTTMEN1KMT2A
SCHEMBL8298242 0.79 LMNA (0.59) LMNATP53HTTMEN1KMT2A
SCHEMBL8353840 0.79 LMNA (0.59) LMNATP53HTTMEN1KMT2A
SCHEMBL19958765 0.77 LMNA (0.62) LMNATP53HTTMEN1KMT2A
SCHEMBL10315783 0.77 LMNA (0.57) LMNATP53HTTMEN1KMT2A
SCHEMBL19832462 0.77 LMNA (0.62) LMNATP53HTTMEN1KMT2A
Hydrochloric Acid SCHEMBL19947097 0.76 LMNA (0.60) LMNATP53HTTMEN1KMT2A
SCHEMBL20131002 0.76 LMNA (0.55) LMNATP53HTTMEN1KMT2A

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-0736509-B1 Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL CO (JP) 2001-11-14 EP disclosed
US-6025531-A REACTING A PROCHIRAL KETONE WITH A MIXTURE BORON-CONTAINING COMPOUNDS HAVING A BORANE REACTION PRODUCT FROM OPTICALLY ACTIVE BETA-AMINOALCOHOL AND A BORON HYDRIDE OR A METAL BOROHYDRIDE, AND AN OPTICALLY ACTIVE OXAZABOROLIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-15 US disclosed
US-5801280-A Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-01 US disclosed
EP-0736509-A2 Processes for preparing optically active alcohols and optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-09 EP disclosed