SCHEMBL29338496

SCHEMBL29338496

C=C(Cl)c1ccccc1C(C)Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
TSHR P16473 2/20 0.32
LMNA P02545 2/20 0.32
FAAH O00519 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
HTR2B P41595 1/20 0.32
GABRA2 P47869 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
SCHEMBL14957087 0.82 GABRA1 (0.34) GABRA1GABRB2TSHRLMNAFAAH
SCHEMBL11502158 0.79 GABRA1 (0.35) GABRA1GABRB2TSHRLMNAFAAH
SCHEMBL6905434 0.79 ALDH1A1 (0.47) GABRA1GABRB2TSHRMAPT
SCHEMBL29056470 0.77 ALDH1A1 (0.34)
SCHEMBL29338538 0.76 GABRA1 (0.33) GABRA1GABRB2TSHRLMNAFAAH
SCHEMBL1567403 0.75 ALDH1A1 (0.52) TSHRCA1CA2HPGDPTGS1
SCHEMBL2865478 0.74 GABRA1 (0.43) GABRA1GABRB2TSHRLMNAFAAH
SCHEMBL10407367 0.73 IRAK4 (0.50) TSHRHPGDMAPTATM
SCHEMBL6829698 0.70 GABRA1 (0.37) GABRA1GABRB2TSHRLMNAFAAH
SCHEMBL27919582 0.69 TSHR (0.41) TSHRLMNAATM

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
WO-2024151024-A1 COMPOUND FOR CAPPING LAYER AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 진웅산업 2024-07-18 WO disclosed