SCHEMBL9602429

SCHEMBL9602429

Cc1nc2ccc(F)cc2c(NCC(O)CO)c1N

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.42
▸ SCN9A Q15858 2/20 0.41
▸ MPO P05164 1/20 0.39
▸ CASP3 P42574 3/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ NTRK1 P04629 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
SCHEMBL9602321 0.77 APP (0.48) PLA2G2A
SCHEMBL9601926 0.76 CASP3 (0.46) KCNH2MPOCASP3PLA2G2A
SCHEMBL9602379 0.71 BCHE (0.51) KCNH2MPOCASP3PLA2G2A
SCHEMBL9588712 0.68 SLC2A1 (0.42) SCN9A
Water SCHEMBL9603060 0.65 POLB (0.38) KCNH2SCN9AMPOCASP3PLA2G2A
SCHEMBL3399719 0.65 POLB (0.60) SCN9A
SCHEMBL3399725 0.65 POLB (0.60) SCN9A
SCHEMBL31663105 0.62 MPO (0.54) KCNH2MPOCASP3PLA2G2A
SCHEMBL15491649 0.62 CASP3 (0.48) MPOCASP3PLA2G2A
SCHEMBL13975711 0.62 KCNH2 (0.85) KCNH2

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
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