SCHEMBL11782833

SCHEMBL11782833

Cc1c(C(=O)c2cccc(C(C)C)c2C)cccc1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.46
GABRG2 P18507 2/20 0.46
GABRB3 P28472 2/20 0.46
LMNA P02545 2/20 0.46
GABRB2 P47870 2/20 0.46
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
GABRB1 P18505 2/20 0.46
FAAH O00519 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CYP1A2 P05177 1/20 0.46
HPGD P15428 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
HTR2C P28335 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
HTR2B P41595 1/20 0.46
GABRA2 P47869 1/20 0.46

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
SCHEMBL1535968 0.86 TSHR (0.53) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL9945912 0.86 GABRA1 (0.45) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL13815355 0.86 AKR1C3 (0.53) LMNAKCNK3KCNK9SMN1; SMN2MAPT
SCHEMBL24692389 0.84 IRAK4 (0.44) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1536722 0.84 GABRA1 (0.43) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL13623381 0.82 GABRA1 (0.42) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL1148330 0.82 GABRA1 (0.52) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL13243338 0.82 ALOX15 (0.51) LMNATSHRHPGDPTGS1KMT2A
SCHEMBL24247195 0.81 PLK1 (0.47) GABRA1GABRG2GABRB3LMNAGABRB2
SCHEMBL18763821 0.81 KDM4E (0.50) LMNATSHRKCNK3KCNK9KMT2A

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
US-3941898-A Developing method utilizing pulverized, colored, crosslinked, vinylic polymer resin as toner FUJI XEROX CO., LTD. (JA) 1976-03-02 US disclosed