SCHEMBL11196399

SCHEMBL11196399

CCCCCCCC12CCC(CC1)C2

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 1/20 0.37
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
GAA P10253 4/20 0.36
TSHR P16473 1/20 0.33
THRB P10828 1/20 0.33

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
SCHEMBL4819390 1.00 MEN1 (0.40) MEN1KMT2AEPHX2GRIN2DGRIN3B
SCHEMBL11201357 1.00 MEN1 (0.40) MEN1KMT2AEPHX2GRIN2DGRIN3B
SCHEMBL2356470 0.91 MEN1 (0.42) MEN1KMT2AEPHX2GRIN2DGRIN3B
SCHEMBL7747839 0.85 CCR2 (0.35) GAATSHRTHRB
SCHEMBL891886 0.82 MEN1 (0.38) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL8626986 0.80 GRIN2D (0.48) MEN1KMT2AEPHX2GRIN2DGRIN3B
SCHEMBL2587668 0.79 GRIN2D (0.36) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL21501061 0.79 GRIN2D (0.61) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL8947159 0.78 GRIN2D (0.59) MEN1KMT2AEPHX2GRIN2DGRIN3B
SCHEMBL4301888 0.78 GRIN2D (0.59) MEN1KMT2AEPHX2GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0070147-A1 Preparation of poly(arylene) ketones RAYCHEM CORPORATION (a California corporation) (US) 1983-01-19 EP disclosed
US-4113753-A Tetra (bicycloheptyl) transition metal compounds HERCULES INCORPORATED (US) 1978-09-12 US disclosed