SCHEMBL10696498

SCHEMBL10696498

C[CH]CC(C)CCCC(C)(C)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ KCNH3 Q9ULD8 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
SCHEMBL16357610 0.81 ALDH1A1 (0.50) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL94185 0.81 MEN1 (0.39) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL5604094 0.81 MEN1 (0.39) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL5306831 0.81 MEN1 (0.39) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL464975 0.81 MEN1 (0.39) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL14867325 0.81 MEN1 (0.47) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL14867327 0.81 MEN1 (0.47) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL8433661 0.79 MEN1 (0.38) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL15255183 0.78 MEN1 (0.37) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL15257171 0.78 MEN1 (0.37) MEN1KMT2ACYP3A4ALOX15ALDH1A1

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
EP-0251644-A2 Perfume composition containing a derivative of hydroxy citronellal Takasago Perfumery Co., Ltd. (JP) 1988-01-07 — — EP disclosed
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