SCHEMBL5327079

SCHEMBL5327079

CCCCCCCCCCCCCCC(I)[N+]1(C(C)C)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
OPRM1 P35372 1/20 0.35
SPHK1 Q9NYA1 1/20 0.34
TSHR P16473 2/20 0.32
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
ADH7 P40394 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
DNM1 Q05193 2/20 0.32
ACE2 Q9BYF1 1/20 0.32
THRB P10828 1/20 0.31
GPR84 Q9NQS5 3/20 0.31
FDPS P14324 3/20 0.31
FFAR1 O14842 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
SCHEMBL5283115 1.00 LMNA (0.42) LMNAOPRM1SPHK1TSHRADH1B
SCHEMBL5296457 0.90 LMNA (0.46) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5306636 0.90 LMNA (0.46) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5290928 0.90 LMNA (0.46) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5300306 0.90 LMNA (0.46) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5293795 0.90 LMNA (0.46) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5288523 0.78 LMNA (0.43) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5294847 0.78 LMNA (0.43) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL1253417 0.78 LMNA (0.43) LMNAOPRM1SPHK1TSHRDNM1
SCHEMBL5287279 0.77 LMNA (0.42) LMNAOPRM1SPHK1TSHRDNM1

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
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed