SCHEMBL8977378

SCHEMBL8977378

CC1CCC(N(C)C(=O)Cl)CC1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
TSHR P16473 2/20 0.38
EPHX1 P07099 1/20 0.36
BRD4 O60885 1/20 0.33
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ADRA2A P08913 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL8053344 0.91
SCHEMBL9957386 0.83
SCHEMBL8054344 0.81 FAAH (0.45) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL13744118 0.79 DPP4 (0.38) ALDH1A1EPHX1BRD4
SCHEMBL5949432 0.79 DPP4 (0.38) ALDH1A1EPHX1BRD4
SCHEMBL8977229 0.79 FAAH (0.48) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL427210 0.79 FAAH (0.48) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL14492205 0.79 DPP4 (0.38) ALDH1A1EPHX1BRD4
SCHEMBL8977352 0.78 ALDH1A1 (0.35) ALDH1A1TSHREPHX1HPGD
SCHEMBL16424652 0.77 EPHX1 (0.41) ALDH1A1TSHREPHX1

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-0708097-A1 Herbicidally active tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1996-04-24 EP disclosed