SCHEMBL9764653

SCHEMBL9764653

CC(C)c1ccccc1NNc1ccccc1C(C)C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.57
POLB P06746 1/20 0.52
GABRA1 P14867 3/20 0.48
GABRB2 P47870 2/20 0.48
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
FAAH O00519 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL12743119 0.89 TDP1 (0.50) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL3958491 0.84 L3MBTL1 (0.57) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL2737240 0.82 L3MBTL1 (0.55) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL6399608 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL18991348 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL892805 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
Hydrochloric Acid SCHEMBL2860733 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL3217546 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL20743821 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D
SCHEMBL8299854 0.80 L3MBTL1 (0.53) L3MBTL1POLBGABRA1GABRB2GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4987258-A Intermediates for disazo dyes HOECHST AKTIENGESELLSCHAFT (DE) 1991-01-22 US disclosed
EP-0196574-B1 4,4'-DIAMINODIPHENYL COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-10 EP disclosed
EP-0196574-A2 4,4'-Diaminodiphenyl compounds, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1986-10-08 EP disclosed