SCHEMBL13636373

SCHEMBL13636373

CC1CCC(c2ccc(I)cc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 9/20 0.63
POLB P06746 1/20 0.37
CYP2C9 P11712 2/20 0.35
ESR1 P03372 2/20 0.35
CYP3A4 P08684 1/20 0.35
HRH3 Q9Y5N1 1/20 0.33
GRIA4 P48058 2/20 0.33
SPHK1 Q9NYA1 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL18647030 0.94 ESR2 (0.57) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL19401242 0.94 ESR2 (0.57) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL10013956 0.89 ESR2 (0.52) ESR2CYP2C9ESR1CYP3A4HRH3
SCHEMBL11196166 0.88 ESR2 (0.77) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL3453587 0.88 ESR2 (0.46) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL11187392 0.81 ESR2 (0.68) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL11187396 0.81 ESR2 (0.68) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL11028999 0.81 ESR2 (0.43) ESR2
SCHEMBL24597681 0.79 ESR2 (0.65) ESR2POLBCYP2C9ESR1CYP3A4
SCHEMBL19937427 0.79 ESR2 (0.65) ESR2POLBCYP2C9ESR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021085279-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION DEVICE, AND ANTENNA DIC株式会社 2021-05-06 WO disclosed
EP-3725764-A1 POLYMERIZABLE COMPOUND HAVING METHOXYMETHYL ACRYLIC GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC Corporation (JP) 2020-10-21 EP disclosed
US-10287501-B2 Liquid crystal display element TOKYO INSTITUTE OF TECHNOLOGY (JP) 2019-05-14 US disclosed
WO-2019025398-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2019-02-07 WO disclosed
WO-2018073158-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2018-04-26 WO disclosed
EP-2123623-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2009-11-25 EP disclosed