SCHEMBL13325832

SCHEMBL13325832

c1ccc2cc(-c3cn4ccc5ccccc5c4n3)ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.68
RAB9A P51151 9/20 0.68
NPC1 O15118 7/20 0.68
KDM4E B2RXH2 6/20 0.68
MAPT P10636 4/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
NFKB1 P19838 4/20 0.68
NFKB2 Q00653 4/20 0.68
RELA Q04206 4/20 0.68
HPGD P15428 3/20 0.68
TP53 P04637 3/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
LMNA P02545 1/20 0.68
BLM P54132 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ALDH1A3 P47895 3/20 0.42
ALDH1A2 O94788 2/20 0.42
POLB P06746 1/20 0.42
CYP1A2 P05177 2/20 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
SCHEMBL970511 0.90 RAB9A (0.64) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL13479824 0.86 ALDH1A1 (0.59) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL11252935 0.84 ALDH1A1 (0.72) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL11419932 0.84 ALDH1A1 (0.71) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL11255204 0.84 ALDH1A1 (0.59) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL14767823 0.82 RAB9A (0.68) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL13325835 0.82 ALDH1A1 (0.72) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL973021 0.82 RAB9A (0.68) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL11886026 0.78 ALDH1A1 (0.50) ALDH1A1RAB9ANPC1KDM4EMAPT
SCHEMBL5738164 0.78 ALDH1A3 (0.51) ALDH1A1RAB9ANPC1KDM4EMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed