SCHEMBL13994398

SCHEMBL13994398

Fc1cccc(BCc2cccc(F)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 4/20 0.47
▸ IDO1 P14902 2/20 0.46
▸ AGXT P21549 2/20 0.46
▸ MIF P14174 1/20 0.42
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SLC6A3 Q01959 2/20 0.40
▸ MAOB P27338 4/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DRD2 P14416 1/20 0.38
▸ SLC6A4 P31645 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
SCHEMBL2686945 0.90 TAAR1 (0.41) TAAR1IDO1AGXTMIFCYP11B1
SCHEMBL13994399 0.82 ACHE (0.44) TAAR1CYP11B1CYP11B2ALDH1A1SMN1; SMN2
SCHEMBL2688429 0.79 TAAR1 (0.45) TAAR1CYP11B1CYP11B2
SCHEMBL12533509 0.75 TAAR1 (0.50) TAAR1IDO1AGXTMIFALDH1A1
SCHEMBL13994420 0.73 TAAR1 (0.41) TAAR1IDO1AGXTMIFCYP11B1
SCHEMBL3300303 0.71 TAAR1 (0.60) TAAR1IDO1AGXTMIFCYP11B1
SCHEMBL3371633 0.71 TAAR1 (0.74) TAAR1IDO1AGXTMIFALDH1A1
SCHEMBL9971249 0.69 — —
SCHEMBL283775 0.69 — —
SCHEMBL19615043 0.69 — —

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
US-7470015-B2 Inkjet-recording ink composition and image-forming process FUJIFILM CORPORATION (JP) 2008-12-30 — — US disclosed
US-7407735-B2 Light sensitive planographic printing plate precursor and its processing method KONICA CORPORATION (JP) 2008-08-05 — — US disclosed
US-7229737-B2 Photopolymerizable composition and recording material and recording process using the same FUJIFILM CORPORATION (JP) 2007-06-12 — — US disclosed
US-20070047038-A1 Hologram recording method, hologram recording material, optical recording medium FUJI PHOTO FILM CO., LTD. 2007-03-01 — — US disclosed
US-20070048666-A1 Two-photon recording method, two-photon absorption recording material, two-photon absorption recording-reproduction method and optical recoding medium FUJI PHOTO FILM CO., LTD. 2007-03-01 — — US disclosed
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