SCHEMBL15428443

SCHEMBL15428443

C/C(=C\Nc1ccccc1C(=O)O)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.50
ALDH1A1 P00352 6/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NR1H4 Q96RI1 8/20 0.44
PPARG P37231 5/20 0.44
PKM P14618 1/20 0.44
KDM4E B2RXH2 3/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 2/20 0.43
ESRRG P62508 2/20 0.42
PPARA Q07869 3/20 0.42
PPARD Q03181 1/20 0.42
EPHX2 P34913 1/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL15428444 1.00 HCAR2 (0.50) HCAR2ALDH1A1L3MBTL1NR1H4PPARG
SCHEMBL31412797 0.88 KMT2A (0.45) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL4435895 0.88 KMT2A (0.45) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL4435898 0.88 KMT2A (0.45) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL18952376 0.83 NR1H4 (0.43) HCAR2ALDH1A1NR1H4PPARGKDM4E
SCHEMBL4858205 0.74 LMNA (0.49) ALDH1A1NR1H4KDM4EMAPTESRRG
SCHEMBL4248365 0.72 FABP4 (0.65) HCAR2ALDH1A1NR1H4PPARGMAPT
SCHEMBL29047128 0.71 TRPM8 (0.57) HCAR2NR1H4PPARGMAPTPPARA
N-Methylanthranilic Acid SCHEMBL3275621 0.71 TP53 (0.60) HCAR2ALDH1A1NR1H4PPARGKDM4E
SCHEMBL6105957 0.71 NR1H4 (0.78) HCAR2ALDH1A1L3MBTL1NR1H4PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4084769-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT Firmenich SA (CH) 2022-11-09 EP claimed
WO-2021214205-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT FIRMENICH SA (CH) 2021-10-28 WO claimed
CN-109476570-B 6-isopropyl-2, 4-dimethylcyclohexen-1-ol compounds as fragrance ingredients 奇华顿股份有限公司 2022-06-07 CN disclosed
CN-107848924-B 2,4, 7-Trimethyloct-6-en-1-ol as fragrance ingredient 奇华顿股份有限公司 2021-04-02 CN disclosed
EP-3233022-B1 PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2021-03-17 EP disclosed
EP-3034064-A1 Perfume composition Givaudan Schweiz AG (CH) 2016-06-22 EP disclosed
US-8637259-B1 Methods of identifying modulators of olfactory receptors involved in the perception of sweat carboxylic acids CHEMCOM S.A. (BE) 2014-01-28 US disclosed