SCHEMBL22882292

SCHEMBL22882292

CNCCCNCC(C(C)C)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.33
EPHX1 P07099 1/20 0.33
MEN1 O00255 1/20 0.31
GLA P06280 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
KISS1R Q969F8 1/20 0.31

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
SCHEMBL3348281 0.80 HRH4 (0.38) PAOXEPHX1MEN1GLACYP2C19
SCHEMBL13354516 0.77 PKM (0.34) PAOXEPHX1KISS1R
SCHEMBL21466313 0.76 LMNA (0.40)
SCHEMBL9238486 0.76 KMT2A (0.38) PAOXEPHX1MEN1CYP2C19KMT2A
SCHEMBL19104227 0.76 CA12 (0.48) PAOXMEN1CYP2C19KMT2A
SCHEMBL21466314 0.74 LMNA (0.44)
SCHEMBL24508702 0.73 EPHX1 (0.46) PAOXEPHX1KISS1R
SCHEMBL25557251 0.73 EPHX1 (0.46) PAOXEPHX1KISS1R
SCHEMBL25832099 0.73 EPHX1 (0.46) PAOXEPHX1KISS1R
SCHEMBL3024820 0.73 CYP2C19 (0.53) PAOXEPHX1MEN1GLACYP2C19

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-3096751-B1 12-EPI-PLEUROMUTILINS Nabriva Therapeutics GmbH (AT) 2021-01-06 EP disclosed