SCHEMBL6748554

SCHEMBL6748554

O=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.64
LMNA P02545 1/20 0.64
IL1R1 P14778 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
KDM4E B2RXH2 1/20 0.50
ATM Q13315 1/20 0.50
POLB P06746 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAOA P21397 1/20 0.40
THRB P10828 1/20 0.40
MAPK1 P28482 1/20 0.39
MAPK8 P45983 2/20 0.39
AGTR1 P30556 2/20 0.39
PGR P06401 1/20 0.38
MAPK9 P45984 1/20 0.38

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
SCHEMBL28220083 0.90 ALDH1A1 (0.52) ALDH1A1LMNAIL1R1L3MBTL1KMT2A
SCHEMBL9509638 0.86 ALDH1A1 (0.52) ALDH1A1LMNAL3MBTL1KMT2AMEN1
SCHEMBL9505790 0.86 ALDH1A1 (0.49) ALDH1A1LMNAIL1R1L3MBTL1KMT2A
SCHEMBL9505772 0.79 ALDH1A1 (0.49) ALDH1A1LMNAIL1R1L3MBTL1KMT2A
SCHEMBL18803008 0.78 IL1R1 (0.62) ALDH1A1LMNAIL1R1L3MBTL1KMT2A
SCHEMBL2343158 0.78 KDM4E (0.52) ALDH1A1LMNAL3MBTL1KMT2AMEN1
SCHEMBL1429358 0.78 ALDH1A1 (1.00) ALDH1A1LMNAL3MBTL1MAPTHTT
SCHEMBL29954953 0.78 KDM4E (0.52) ALDH1A1LMNAL3MBTL1KMT2AMEN1
SCHEMBL22443301 0.78 L3MBTL1 (0.52) ALDH1A1LMNAL3MBTL1KMT2AMEN1
SCHEMBL29822336 0.77 IL1R1 (0.60) ALDH1A1LMNAIL1R1L3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-6706423-B2 Organic EL device LIGHTRONIK TECHNOLOGY INC. (TW) 2004-03-16 US disclosed
US-20030165712-A1 Organic EL Device LIGHTRONIK TECHNOLOGY INC. (TW) 2003-09-04 US disclosed
EP-0296873-B1 DIRECT POSITIVE DIMETHINE CYANINE DYES CONTAINING 1-ARYL-2-HETEROARYL INDOLE NUCLEUS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-09-08 EP disclosed
US-5004812-A Phenyl-pyridyl-indole Intermediates For Desensitizing Dyes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-02 US disclosed
US-4927933-A PHOTOGRAPHIC FILMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-05-22 US disclosed
US-4839271-A SENSITIZERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-13 US disclosed
EP-0296873-A2 Direct positive dimethine cyanine dyes containing 1-aryl-2-heteroaryl indole nucleus E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-12-28 EP disclosed