SCHEMBL9400807

SCHEMBL9400807

CCCCCN(C)C(CO)C(C)N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 4/20 0.38
▸ DNM1 Q05193 3/20 0.37
▸ SPHK2 Q9NRA0 2/20 0.37
▸ CETP P11597 2/20 0.37
▸ CYP2D6 P10635 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ GMNN O75496 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ UBE2N P61088 1/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ GGPS1 O95749 1/20 0.33

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
SCHEMBL14640350 0.81 SPHK1 (0.47) SPHK1DNM1CETPCYP2D6LMNA
SCHEMBL10953399 0.74 DNM1 (0.50) DNM1OPRM1GGPS1
SCHEMBL20726267 0.73 SPHK2 (0.37) SPHK1SPHK2CETP
SCHEMBL23005961 0.73 DNM1 (0.50) SPHK1DNM1OPRM1GGPS1
Hydrochloric Acid SCHEMBL3423078 0.72 DNM1 (0.48) DNM1LMNAGGPS1
SCHEMBL20142325 0.72 DNM1 (0.55) DNM1GGPS1
SCHEMBL20142376 0.72 DNM1 (0.55) DNM1GGPS1
SCHEMBL21126454 0.72 DNM1 (0.55) DNM1GGPS1
SCHEMBL20142278 0.72 DNM1 (0.55) DNM1GGPS1
SCHEMBL15006368 0.72 DNM1 (0.55) DNM1GGPS1

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
US-5291905-A Hair treatment applicator HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1994-03-08 — — US disclosed
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