SCHEMBL27004472

SCHEMBL27004472

N=C(Nc1nc2c(F)cc(F)cc2s1)C(Cl)(Cl)Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.56
▸ NPC1 O15118 9/20 0.56
▸ MEN1 O00255 7/20 0.56
▸ KMT2A Q03164 7/20 0.56
▸ MAPT P10636 7/20 0.56
▸ ALDH1A1 P00352 5/20 0.56
▸ TDP1 Q9NUW8 3/20 0.56
▸ PKM P14618 3/20 0.56
▸ HTT P42858 4/20 0.54
▸ LMNA P02545 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ AGTR1 P30556 1/20 0.54
▸ OPRK1 P41145 1/20 0.54
▸ HPGD P15428 2/20 0.50
▸ MCL1 Q07820 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ TP53 P04637 1/20 0.46
▸ GAA P10253 4/20 0.46
▸ TNF P01375 2/20 0.46

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
SCHEMBL31504583 0.83 RAB9A (0.64) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL27004512 0.83 RAB9A (0.64) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL27004521 0.81 NPC1 (0.59) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL3792415 0.77 RAB9A (0.70) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL27004518 0.76 ALDH1A1 (0.46) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL3044982 0.75 RAB9A (0.68) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL21589413 0.75 NPC1 (0.65) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL27004523 0.75 ALDH1A1 (0.55) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL2136763 0.72 RAB9A (1.00) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL4921505 0.71 NPC1 (0.62) RAB9ANPC1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306109-A1 NEW ANTIBIOTIC COMPOUNDS Université de la Côte d'Azur (FR) 2024-01-17 — — EP disclosed
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