SCHEMBL28090451

SCHEMBL28090451

Ic1c[nH]c2ccccc12.c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.45
FFAR1 O14842 1/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
NPC1 O15118 1/20 0.44
MITF O75030 1/20 0.44
RAB9A P51151 1/20 0.44
SRC P12931 1/20 0.43
ATM Q13315 1/20 0.42
PRKCB P05771 2/20 0.41
MAPT P10636 2/20 0.41
CYP3A4 P08684 2/20 0.41
AHR P35869 1/20 0.41
HSD17B10 Q99714 3/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41

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
SCHEMBL29472310 0.86 ATM (0.54) GPR84FFAR1MEN1KMT2AALDH1A1
SCHEMBL84022 0.86 ATM (0.54) GPR84FFAR1MEN1KMT2AALDH1A1
Propionic Acid SCHEMBL19133597 0.77 ADAM17 (0.50) GPR84MEN1KMT2AALDH1A1MAPT
SCHEMBL10617441 0.77 MEN1 (0.58) GPR84FFAR1MEN1KMT2AALDH1A1
Thiourea SCHEMBL8083677 0.73 IDO1 (0.51) GPR84MEN1KMT2AALDH1A1TDP1
Carbazole SCHEMBL27949687 0.71 ALDH1A1 (0.67) MEN1KMT2AALDH1A1TDP1ATM
Carbazole SCHEMBL1734120 0.71 ALDH1A1 (0.67) MEN1KMT2AALDH1A1TDP1ATM
Carbazole SCHEMBL28132811 0.71 ALDH1A1 (0.67) MEN1KMT2AALDH1A1TDP1ATM
SCHEMBL1072588 0.71 ATM (0.50) GPR84MEN1KMT2AALDH1A1TDP1
Carbazole SCHEMBL27857805 0.70 ALDH1A1 (0.64) MEN1KMT2AALDH1A1TDP1ATM

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
CN-105777607-A Triphenylamine bis-indolyl iodised salt as well as synthesis method and application thereof 山西大学 2016-07-20 CN claimed
CN-105777607-A Triphenylamine bis-indolyl iodised salt as well as synthesis method and application thereof 山西大学 2016-07-20 CN disclosed