SCHEMBL18265490

SCHEMBL18265490

CC(C)=CCOc1ccc(/C=C/C(=O)O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
NR1I2 O75469 1/20 0.63
LMNA P02545 1/20 0.63
PGR P06401 1/20 0.63
ADRB2 P07550 1/20 0.63
ADRB1 P08588 1/20 0.63
ADORA3 P0DMS8 1/20 0.63
MAPT P10636 1/20 0.63
HPGD P15428 1/20 0.63
CNR1 P21554 1/20 0.63
TBXA2R P21731 1/20 0.63
SLC6A2 P23975 1/20 0.63
AGTR1 P30556 1/20 0.63
ADRA1A P35348 1/20 0.63
OPRD1 P41143 1/20 0.63
OPRK1 P41145 1/20 0.63
BLM P54132 1/20 0.63
SLC6A3 Q01959 1/20 0.63
KMT2A Q03164 1/20 0.63
NDUFS8 O00217 1/20 0.58

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
SCHEMBL7028421 0.88 MTNR1A (0.68) MEN1NR1I2LMNAPGRADRB2
SCHEMBL7028418 0.88 MTNR1A (0.68) MEN1NR1I2LMNAPGRADRB2
SCHEMBL7028422 0.88 MTNR1A (0.68) MEN1NR1I2LMNAPGRADRB2
SCHEMBL10424645 0.87 MTNR1A (0.67) MEN1NR1I2LMNAPGRADRB2
SCHEMBL10424644 0.87 MTNR1A (0.67) MEN1NR1I2LMNAPGRADRB2
SCHEMBL18265480 0.87 MTNR1A (0.67) MEN1NR1I2LMNAPGRADRB2
SCHEMBL29216352 0.85 MAPT (0.57) MEN1NR1I2LMNAPGRADRB2
SCHEMBL29216351 0.85 MAPT (0.57) MEN1NR1I2LMNAPGRADRB2
SCHEMBL11582550 0.85 MAPT (0.64) MEN1NR1I2LMNAPGRADRB2
SCHEMBL11582552 0.85 MAPT (0.64) MEN1NR1I2LMNAPGRADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3097904-B1 DEPIGMENTING AGENTS TO LIGHTEN THE SKIN AFFICHEM (FR) 2019-08-14 EP disclosed
WO-2016193220-A1 SKIN PIGMENTATION MODIFIERS TO DARKEN OR LIGHTEN THE SKIN AFFICHEM (FR) 2016-12-08 WO disclosed
EP-3097904-A1 DEPIGMENTING AGENTS TO LIGHTEN THE SKIN Affichem (FR) 2016-11-30 EP disclosed