SCHEMBL14101206

SCHEMBL14101206

C/C=N/c1c(C)cccc1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
GABRA1 P14867 3/20 0.39
CYP3A4 P08684 3/20 0.39
LMNA P02545 3/20 0.39
TSHR P16473 3/20 0.39
HIF1A Q16665 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRB2 P47870 2/20 0.39
FAAH O00519 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HPGD P15428 1/20 0.39
GABRB1 P18505 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL4948085 0.88 GABRA1 (0.44) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL14101410 0.88 GABRA1 (0.44) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL16471864 0.85 GABRA1 (0.39) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL1826151 0.81 ATM (0.41) CYP1A2TSHRCA1CA2KMT2A
SCHEMBL1826153 0.81 ATM (0.41) CYP1A2TSHRCA1CA2KMT2A
SCHEMBL23706906 0.81 ATM (0.41) CYP1A2TSHRCA1CA2KMT2A
SCHEMBL5587268 0.81 GABRA1 (0.39) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL22910258 0.80 GABRA1 (0.35) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL25801459 0.80 GABRA1 (0.35) CYP1A2GABRA1CYP3A4LMNATSHR
SCHEMBL21694954 0.79 GABRA1 (0.50) CYP1A2GABRA1CYP3A4LMNATSHR

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
EP-1577314-B1 Catalyst based on a transition metal complex for polymerization of olefins, and process for polymerization of olefins using the catalyst TOSOH CORP (JP) 2008-08-27 EP disclosed