SCHEMBL9832004

SCHEMBL9832004

[CH]=Cc1ccc(N(C)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
ALDH1A1 P00352 5/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
LMNA P02545 3/20 0.51
MAPK1 P28482 3/20 0.51
HPGD P15428 2/20 0.51
S1PR4 O95977 1/20 0.51
HSP90AA1 P07900 1/20 0.51
S1PR1 P21453 1/20 0.51
CCR6 P51684 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TLR9 Q9NR96 1/20 0.51
KDM4E B2RXH2 3/20 0.49
MAPT P10636 3/20 0.49
RELA Q04206 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
NFKB1 P19838 1/20 0.49

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
SCHEMBL27787541 0.83 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL586572 0.82 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7155149 0.81 NR3C2 (0.56) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL12626684 0.80 RELA (0.72) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL95663 0.78 CYP2A6 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL9832011 0.78 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL20385081 0.78 MEN1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL22931682 0.78 MEN1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
Benzene SCHEMBL14537401 0.78 MEN1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL6567354 0.78 MEN1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101611066-B Improved epoxy compositions TRILLION SCIENCE INC US 2012-03-21 CN disclosed
CN-101611066-A The epoxy composite of improvement TRILLION SCIENCE INC (US) 2009-12-23 CN disclosed
EP-0304613-B1 BENZOPYRAN DERIVATIVES BASF Aktiengesellschaft (DE) 1991-06-26 EP disclosed
US-4958021-A PRESSURE AND HEAT SENSITIVE RECORDING MATERIALS BASF AKTIENGESELLSCHAFT (DE) 1990-09-18 US disclosed
EP-0304613-A1 Benzopyran derivatives BASF Aktiengesellschaft (DE) 1989-03-01 EP disclosed