SCHEMBL11800432

SCHEMBL11800432

CCCCOC(=O)C(C)Oc1ccc2ccccc2c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NCEH1 Q6PIU2 3/20 0.46
TDP1 Q9NUW8 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
GAA P10253 1/20 0.45
CNR1 P21554 3/20 0.44
CNR2 P34972 3/20 0.44
ALDH1A1 P00352 2/20 0.44
KCNH2 Q12809 3/20 0.43
CYP2C9 P11712 2/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.40
HPGD P15428 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 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
SCHEMBL11798018 0.93 LMNA (0.51) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL11810433 0.87 LMNA (0.53) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL11832835 0.84 LMNA (0.44) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
Lonaprofen SCHEMBL29670159 0.82 NCEH1 (0.56) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
Lonaprofen SCHEMBL2109183 0.82 NCEH1 (0.56) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL11804487 0.81 LMNA (0.47) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL11807725 0.80 NCEH1 (0.54) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL11584986 0.79 LMNA (0.50) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL19608990 0.77 GAA (0.61) LMNASMN1; SMN2NCEH1TDP1L3MBTL1
SCHEMBL28418683 0.76 TSHR (0.44) LMNAALDH1A1TP53TSHRMAPT

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
US-3968145-A ANALGESIC, ANTIPYRETIC, ANTIPHLOGISTIC A. MENARINI S.A.S. (IT) 1976-07-06 US disclosed