SCHEMBL16285017

SCHEMBL16285017

CN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCO)C5=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.73
KDM4E B2RXH2 5/20 0.73
HTT P42858 4/20 0.73
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
SMN1; SMN2 Q16637 2/20 0.73
RGS12 O14924 1/20 0.73
NPC1 O15118 1/20 0.73
LMNA P02545 1/20 0.73
PABPC1 P11940 1/20 0.73
RECQL P46063 1/20 0.73
RAB9A P51151 1/20 0.73
STAT3 P40763 1/20 0.58
HIF1A Q16665 1/20 0.58
TERT O14746 7/20 0.57
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TSHR P16473 1/20 0.44
HEXA P06865 1/20 0.42
HEXB P07686 1/20 0.42

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
SCHEMBL14302831 0.94 KDM4E (0.83) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL14309279 0.92 KDM4E (0.86) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL14303164 0.88 KDM4E (0.77) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL12627920 0.87 KDM4E (0.96) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL17718731 0.87 KDM4E (0.71) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL13028098 0.87 STAT3 (0.60) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL22434039 0.87 STAT3 (0.60) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL18470151 0.86 KDM4E (1.00) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL30105334 0.86 KDM4E (1.00) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL16284978 0.86 KDM4E (0.61) ALDH1A1KDM4EHTTMEN1KMT2A

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-9680103-B2 Organic photoelectric conversion element composition, thin film and photovoltaic cell each containing the same, organic semiconductor polymer and compound each for use in these, and method of producing the polymer FUJIFILM CORPORATION (JP) 2017-06-13 US disclosed
US-20140360585-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT COMPOSITION, THIN FILM AND PHOTOVOLTAIC CELL EACH CONTAINING THE SAME, ORGANIC SEMICONDUCTOR POLYMER AND COMPOUND EACH FOR USE IN THESE, AND METHOD OF PRODUCING THE POLYMER FUJIFILM CORPORATION (JP) 2014-12-11 US disclosed