SCHEMBL11520647

SCHEMBL11520647

CCC(O)Cn1c(C)cc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.59
TP53 P04637 3/20 0.49
TSHR P16473 3/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
HTT P42858 2/20 0.48
KDM4E B2RXH2 4/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
MAPT P10636 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 3/20 0.45
NPC1 O15118 1/20 0.45
CYP1A2 P05177 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL11693545 0.88 PRMT5 (0.56) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL16603956 0.84 BACE1 (0.67) PRMT5TSHRMEN1KMT2AHTT
SCHEMBL11506155 0.83 PRMT5 (0.54) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL8534976 0.83 PRMT5 (0.55) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL20853336 0.81 PRMT5 (0.49) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL17826349 0.81 HPGD (0.63) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL11518221 0.81 ALDH1A1 (0.52) PRMT5TP53TSHRMEN1KMT2A
SCHEMBL11517796 0.80 BACE1 (0.65) KMT2AHTTKDM4EMAPTSMN1; SMN2
SCHEMBL11518431 0.80 LMNA (0.62) PRMT5TSHRMEN1KMT2AHTT
SCHEMBL10412483 0.80 MEN1 (0.52) PRMT5TP53TSHRMEN1KMT2A

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-4180503-A FOR DYEING POLYAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-12-25 US disclosed
US-4124581-A FOR NATURAL AND SYNTHETIC FIBERS, COLORFAST BAYER AKTIENGESELLSCHAFT (DE) 1978-11-07 US disclosed
US-4102893-A Process for the manufacture of color formers of indoles and anhydrides of aromatic or heteroaromatic, vicinal dicarboxylic acids, new color formers of these classes of substance and their use CIBA-GEIGY AG (CH) 1978-07-25 US disclosed
US-4060521-A POLYAMIDE BAYER AKTIENGESELLSCHAFT (DT) 1977-11-29 US disclosed