SCHEMBL8577916

SCHEMBL8577916

CCOC(=O)C1(OC(=O)Cc2ccc(Cl)cc2Cl)CCC2CCCC2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
ADCY8 P40145 1/20 0.39
POLB P06746 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
ALDH1A1 P00352 4/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.37
THRB P10828 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A2 P23975 4/20 0.37
SLC6A4 P31645 4/20 0.37
KDM4E B2RXH2 1/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
GAA P10253 1/20 0.36
P2RX7 Q99572 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
SCHEMBL8576660 0.84 KMT2A (0.41) KMT2AADCY8POLBSIGMAR1ALDH1A1
SCHEMBL8578448 0.84 SMN1; SMN2 (0.34) KMT2APOLBL3MBTL1KDM4EPSEN1
SCHEMBL13548018 0.83 PSEN1 (0.34) POLBPSEN1PSEN2APH1BNCSTN
SCHEMBL13548004 0.83 POLB (0.36) KMT2APOLBALDH1A1MEN1L3MBTL1
SCHEMBL18958947 0.83 KMT2A (0.49) KMT2AADCY8SIGMAR1ALDH1A1HTT
SCHEMBL8574296 0.83 ALDH1A1 (0.39) KMT2APOLBSIGMAR1ALDH1A1MEN1
SCHEMBL8577976 0.83 KMT2A (0.40) KMT2AADCY8SIGMAR1ALDH1A1HTT
SCHEMBL8575823 0.83 KMT2A (0.40) KMT2AADCY8SIGMAR1ALDH1A1HTT
SCHEMBL8579607 0.80 ALDH1A1 (0.41) KMT2AADCY8SIGMAR1ALDH1A1HTT
SCHEMBL8580842 0.80 ADCY8 (0.39) KMT2AADCY8SIGMAR1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719310-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
US-5610122-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-11 US disclosed