SCHEMBL15825985

SCHEMBL15825985

CCCCN(C(=O)O)C1CCC(N2CCC(F)(F)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
OPRL1 P41146 3/20 0.33
OPRM1 P35372 2/20 0.33
LMNA P02545 2/20 0.33
OPRK1 P41145 1/20 0.33
PTBP1 P26599 1/20 0.33
UBE2M P61081 4/20 0.33
DCUN1D1 Q96GG9 4/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALOX15 P16050 1/20 0.32
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
MAPT P10636 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
SCHEMBL3832363 0.80 ALDH1A1 (0.44) ALDH1A1OPRM1LMNAOPRK1PTBP1
SCHEMBL1613958 0.75 L3MBTL1 (0.34) ALDH1A1LMNAPTBP1UBE2MDCUN1D1
SCHEMBL16372187 0.73 OPRL1 (0.34) OPRL1OPRM1OPRK1
SCHEMBL1932588 0.73 L3MBTL1 (0.41) ALDH1A1LMNAPTBP1UBE2MDCUN1D1
SCHEMBL3829259 0.72 OPRM1 (0.44) ALDH1A1OPRM1LMNAPTBP1UBE2M
SCHEMBL5510945 0.71 L3MBTL1 (0.42) L3MBTL1
SCHEMBL2144953 0.70 L3MBTL1 (0.37) ALDH1A1LMNAPTBP1L3MBTL1
SCHEMBL3818321 0.70 SLC6A4 (0.44) L3MBTL1
SCHEMBL2371705 0.69 L3MBTL1 (0.44) ALDH1A1OPRM1LMNAPTBP1L3MBTL1
SCHEMBL16055381 0.68 SLC6A4 (0.40) OPRM1L3MBTL1

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
EP-2935260-A1 BET-PROTEIN-INHIBITING DIHYDROPYRIDOPYRAZINONES Bayer Pharma Aktiengesellschaft (DE) 2015-10-28 EP disclosed
WO-2014095774-A1 BET-PROTEIN-INHIBITING DIHYDROPYRIDOPYRAZINONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-06-26 WO disclosed