SCHEMBL7187904

SCHEMBL7187904

CCn1c(C)c(C(c2ccc(N(C)C)cc2C)c2ccccc2C(=O)OC)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.38
PTGER4 P35408 2/20 0.37
KDM4E B2RXH2 7/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
LMNA P02545 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36

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
SCHEMBL7181782 0.92 MAPT (0.38) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7193629 0.91 KDM4E (0.38) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7193177 0.89 TSHR (0.39) KDM4EMEN1KMT2ALMNAALDH1A1
SCHEMBL7185303 0.88 PTGER4 (0.36) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7188117 0.85 NR4A2 (0.48) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7189604 0.84 GABRP (0.37) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7181940 0.81 GABRG2 (0.46) NR4A2KDM4EMEN1KMT2ALMNA
SCHEMBL10693188 0.81 ALDH1A1 (0.39) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL7188094 0.81 SMN1; SMN2 (0.36) NR4A2PTGER4KDM4EMEN1KMT2A
SCHEMBL7194548 0.80 MAPT (0.35) NR4A2PTGER4KDM4EMEN1KMT2A

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
US-6586364-B2 Shell walls; liquid coloring PENTAX CORPORATION (JP) 2003-07-01 US disclosed
US-20020168580-A1 Heat-sensitive microcapsule and recording medium using same ASAHI KOGAKU KOGYO KABUSHIKI KAISHA 2002-11-14 US disclosed