SCHEMBL9015699

SCHEMBL9015699

CC(C)(C)c1cc(C(=O)Br)cc(C(C)(C)C)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
RECQL P46063 1/20 0.55
CA2 P00918 3/20 0.54
CA1 P00915 2/20 0.54
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
POLB P06746 1/20 0.52
TYR P14679 1/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MAPT P10636 3/20 0.52
MEN1 O00255 2/20 0.52
TSHR P16473 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPK1 P28482 2/20 0.52
USP2 O75604 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
BLM P54132 1/20 0.52
ATM Q13315 1/20 0.52

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
SCHEMBL8495448 0.82 ALOX5 (0.65) LMNARECQLCA2CA1ALDH1A1
SCHEMBL4448135 0.80 LMNA (0.56) LMNARECQLCA2CA1ALDH1A1
SCHEMBL227202 0.80 GLRA3 (0.63) LMNARECQLCA2CA1ALDH1A1
SCHEMBL47718 0.80 SMN1; SMN2 (0.59) LMNARECQLCA2CA1ALDH1A1
SCHEMBL9355788 0.78 GLRA3 (0.61) LMNARECQLCA2CA1ALDH1A1
SCHEMBL6136796 0.78 LMNA (0.55) LMNARECQLCA2CA1ALDH1A1
SCHEMBL8659247 0.78 GLRA3 (0.61) LMNARECQLCA2CA1ALDH1A1
SCHEMBL10001153 0.78 LMNA (0.55) LMNARECQLCA2CA1ALDH1A1
SCHEMBL4257166 0.78 LMNA (0.59) LMNARECQLCA2CA1ALDH1A1
Hydrochloric Acid SCHEMBL1943524 0.78 GLRA3 (0.61) LMNARECQLCA2CA1ALDH1A1

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
US-5516856-A IMPROVED PROCESS FOR THE MODIFICATION OF THE MOLECULAR CHAIN OF A POLYMER ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-05-14 US disclosed
US-5162405-A Single-functional and mixtures of multi-functional oligomeric performance additive compositions and their uses ELF ATOCHEM NORTH AMERICA, INC. (US) 1992-11-10 US disclosed
US-5051531-A As polymerization catalysts and for crosslinking ATOCHEM NORTH AMERICA, INC. (US) 1991-09-24 US disclosed
US-5013777-A Benzosulfonic acids as end groups of engineering thermoplastic resins; fireproofing; oxidation and UV resistances; photostabilizers ATOCHEM NORTH AMERICA, INC. (US) 1991-05-07 US disclosed