SCHEMBL8732128

SCHEMBL8732128

CNc1ccc(Cc2cccc(NC)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
SAE1 Q9UBE0 1/20 0.45
UBA2 Q9UBT2 1/20 0.45
APP P05067 2/20 0.44
MTNR1A P48039 2/20 0.40
MTNR1B P49286 2/20 0.40
LMNA P02545 3/20 0.39
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 2/20 0.39
IDH1 O75874 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CALM1 P0DP23 1/20 0.39
PGR P06401 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
LTA4H P09960 1/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 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
SCHEMBL18905641 0.91 TSHR (0.48) TSHRSAE1UBA2APPMTNR1A
SCHEMBL12707605 0.89 TSHR (0.54) TSHRAPPMTNR1AMTNR1BLMNA
SCHEMBL22602000 0.88 SAE1 (0.46) TSHRSAE1UBA2APPHTT
SCHEMBL21882571 0.82 CA1 (0.51) TSHRSAE1UBA2MTNR1AMTNR1B
SCHEMBL12852535 0.82 CYP17A1 (0.49) TSHRLMNAHTTSMN1; SMN2HPGD
SCHEMBL1108578 0.82 TSHR (0.62) TSHRLMNAHTTSMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL28230977 0.82 LTA4H (0.59) SAE1UBA2APPMTNR1AMTNR1B
SCHEMBL291602 0.82 ALDH1A1 (0.52) TSHRSAE1UBA2APPLMNA
SCHEMBL24146817 0.82 MAPT (0.48) SAE1UBA2HTTLTA4HMAPT
SCHEMBL27919316 0.79 TEAD4 (0.48) TSHRLMNAHTTSMN1; SMN2HPGD

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-5725948-A POLYIMIDE FROM A BISMALEIMIDE AND A DIAMINE TOMOEGAWA PAPER CO., LTD. (JP) 1998-03-10 US disclosed
US-5696235-A CONTAINING A BISMALEIMIDE; HEAT RESISTANCE, PROCESSABILITY; SOLUBLE IN VARIOUS ORGANIC SOLVENTS TOMOEGAWA PAPER CO., LTD. (JP) 1997-12-09 US disclosed