SCHEMBL15532189

SCHEMBL15532189

Fc1cc2c(c(C(F)(F)F)c1)CCC2

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
GPR35 Q9HC97 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IDO1 P14902 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
SCHEMBL21033060 0.78 MEN1 (0.35) MEN1USP2HTTKMT2AKEAP1
SCHEMBL4644733 0.74 MAOA (0.33) MEN1KMT2A
SCHEMBL27899887 0.73 ALDH1A1 (0.47) MEN1USP2HTTKMT2AKEAP1
SCHEMBL806281 0.72 MAPT (0.35) MEN1KMT2A
SCHEMBL19398839 0.72 MEN1 (0.33) MEN1USP2HTTKMT2AKEAP1
SCHEMBL23647865 0.71 CCNB2 (0.31)
Ethane SCHEMBL27539333 0.71 NLRP3 (0.33)
SCHEMBL8436954 0.71 BCL2L1 (0.42) MEN1KMT2A
SCHEMBL31158669 0.71 HTR2A (0.33)
SCHEMBL7792883 0.70 MAOA (0.33) MEN1KMT2A

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-2847190-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2015-03-18 EP disclosed
WO-2013167495-A1 BICYCLICALLY SUBSTITUTED URACILS AND THE USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2013-11-14 WO disclosed