SCHEMBL13497553

SCHEMBL13497553

CCCCC(Br)C(=O)c1cc(C)ccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
POLB P06746 1/20 0.39
TSHR P16473 3/20 0.38
LMNA P02545 3/20 0.38
LCK P06239 1/20 0.38
PPARD Q03181 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 1/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
UTS2R Q9UKP6 2/20 0.36

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
SCHEMBL14707703 0.84 L3MBTL1 (0.46) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL6391071 0.77 TAS1R3 (0.48) POLBTSHRLMNALCKPPARD
SCHEMBL3362703 0.77 MEN1 (0.49) MEN1KMT2APOLBTSHRLMNA
SCHEMBL13070385 0.76 MEN1 (0.43) MEN1KMT2APOLBTSHRLMNA
SCHEMBL13758856 0.75 KMT2A (0.42) MEN1KMT2APOLBTSHRLMNA
SCHEMBL17844017 0.74 MEN1 (0.44) MEN1KMT2APOLBTSHRLMNA
SCHEMBL30859400 0.72 LCK (0.47) TSHRLMNALCKPPARDZDHHC20
SCHEMBL7266974 0.71 UTS2R (0.40) MEN1KMT2APOLBTSHRLMNA
SCHEMBL30859429 0.71 ZDHHC7 (0.48) LMNALCKPPARDZDHHC20ZDHHC2
SCHEMBL4936037 0.71 SLC6A2 (0.56) KMT2ATSHRSMN1; SMN2HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154213-A1 Ink-jet ink composition, and ink-jet recording method Fujifilm Corporation (JP) 2010-02-17 EP disclosed