SCHEMBL12511797

SCHEMBL12511797

C=CCN(C/C=C\c1ccccc1)C(=O)C1CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SIGMAR1 Q99720 3/20 0.44
▸ HTR2A P28223 2/20 0.44
▸ HTR2C P28335 2/20 0.44
▸ HTR2B P41595 2/20 0.44
▸ PAM P19021 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ HPGD P15428 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40

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
SCHEMBL13795650 1.00 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL13795646 0.86 ALDH1A1 (0.58) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL13795318 0.86 ALDH1A1 (0.58) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL12511543 0.86 KDM4E (0.47) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL12511541 0.84 KDM4E (0.46) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL12511407 0.84 KDM4E (0.46) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL12511801 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL12511315 0.83 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1KMT2ASIGMAR1
SCHEMBL11884855 0.83 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL11884840 0.83 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642886-B1 Saturated and unsaturated N-Alkamides exhibiting taste and flavor enhancement effect in flavor compositions INT FLAVORS & FRAGRANCES INC (US) 2016-11-16 — — EP disclosed
EP-2348014-A1 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions International Flavors & Fragrances Inc. (US) 2011-07-27 — — EP disclosed
US-7541055-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-02 — — US disclosed
US-7541055-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-02 — — US disclosed
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