SCHEMBL10654430

SCHEMBL10654430

COc1ccc(Nc2cccc3ccccc23)c(C)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.63
GAA P10253 2/20 0.60
KMT2A Q03164 5/20 0.54
MEN1 O00255 3/20 0.54
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.47
ADRA2A P08913 1/20 0.47
ADRA2C P18825 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
CDC25B P30305 3/20 0.46
TP53 P04637 2/20 0.45
TSHR P16473 2/20 0.45
PTPN11 Q06124 1/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45

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
SCHEMBL10639862 0.84 GAA (0.72) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL11131070 0.81 LMNA (0.52) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL2288991 0.81 ALDH1A1 (0.50) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL10640051 0.80 GAA (0.61) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL1010313 0.78 ALDH1A1 (0.59) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL7002680 0.78 GAA (0.64) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL6439831 0.78 GAA (0.64) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL7001777 0.78 RAB9A (0.68) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL10654473 0.78 ALDH1A1 (0.56) RAB9AGAAKMT2AMEN1ALDH1A1
SCHEMBL30273064 0.78 RAB9A (1.00) RAB9AGAAKMT2AMEN1ALDH1A1

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
EP-0089752-B1 FLUORAN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN RECORDING SYSTEMS KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1988-04-20 EP disclosed
US-4524373-A Fluoran derivatives as new compounds, process for preparing the same and recording system utilizing the same as colorless chromogenic material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1985-06-18 US disclosed
EP-0089752-A2 Fluoran derivatives, process for their preparation and their use in recording systems KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1983-09-28 EP disclosed