SCHEMBL29106978

SCHEMBL29106978

CCCCCCCCCCCCC(N)(CCCC)CCCCCCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.48
FDPS P14324 2/20 0.48
TSHR P16473 2/20 0.47
THRB P10828 1/20 0.47
DNM1 Q05193 8/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.43
EPHX1 P07099 1/20 0.43
GGPS1 O95749 1/20 0.41

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
SCHEMBL4891289 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL2945947 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL16553229 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL6056284 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL4898721 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL6363054 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL4895066 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL5502800 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL21409650 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL7576761 1.00 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1

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
CN-117043136-A Fluorine-based ionic liquid and method for producing same 第一工业制药株式会社 2023-11-10 CN disclosed