SCHEMBL9602609

SCHEMBL9602609

[O-][n+]1cc2ncn(CCc3ccccc3)c2c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
PKM P14618 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 2/20 0.41
CNOT7 Q9UIV1 8/20 0.41
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
ADORA2A P29274 1/20 0.39
LTA4H P09960 2/20 0.37
TNF P01375 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
APP P05067 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL9602275 0.83 DPP4 (0.41) ALDH1A1KMT2ALTA4H
SCHEMBL10727327 0.83 TLR7 (0.36) ALDH1A1KMT2ATSHR
SCHEMBL10588936 0.81 ALDH1A1 (0.41) ALDH1A1KMT2AADORA2A
SCHEMBL1335102 0.80 CSNK2A2 (0.37) HTTKMT2ATSHR
SCHEMBL30601125 0.80 TLR7 (0.47) HTTALDH1A1KMT2AADORA2ATSHR
SCHEMBL4870104 0.80 ADORA2B (0.36) HTTALDH1A1KMT2AADORA2A
SCHEMBL3192664 0.80 TLR7 (0.47) HTTALDH1A1KMT2AADORA2ATSHR
Hydrochloric Acid SCHEMBL3198630 0.79 TLR7 (0.46) HTTALDH1A1KMT2AADORA2ATSHR
SCHEMBL10587329 0.79 NR1I2 (0.41) ALDH1A1KMT2ACNOT7
SCHEMBL9601900 0.79 NR1I2 (0.41) ALDH1A1KMT2ACNOT7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0310950-B1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1993-01-13 EP disclosed
EP-0145340-B1 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1990-01-24 EP disclosed
EP-0310950-A1 Quinoline intermediates for the synthesis of 1H-imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amimes RIKER LABORATORIES, INC. (US) 1989-04-12 EP disclosed
US-4698348-A 1H-imidazo[4,5-c]quinolines and their use as bronchodilating agents RIKER LABORATORIES, INC. (US) 1987-10-06 US disclosed
EP-0145340-A2 1H-Imidazo[4,5-c]quinolines and 1H-imidazo[4,5-c]quinolin-4-amines RIKER LABORATORIES, INC. (US) 1985-06-19 EP disclosed