SCHEMBL11154017

SCHEMBL11154017

O=C(NC(=S)Nc1cc(N2CCOCC2)ccc1Oc1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.65
▸ ALDH1A1 P00352 10/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.65
▸ NPC1 O15118 1/20 0.65
▸ EPHX1 P07099 1/20 0.65
▸ RAB9A P51151 1/20 0.65
▸ KMT2A Q03164 5/20 0.56
▸ NTRK1 P04629 1/20 0.56
▸ LMNA P02545 4/20 0.53
▸ TDP1 Q9NUW8 3/20 0.53
▸ ALOX12 P18054 1/20 0.53
▸ MEN1 O00255 4/20 0.52
▸ GPR55 Q9Y2T6 2/20 0.52
▸ GAA P10253 3/20 0.52
▸ MAPK1 P28482 2/20 0.49

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
SCHEMBL11163790 0.91 ALDH1A1 (0.57) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL3053531 0.89 MAPT (0.66) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11154781 0.84 NTRK1 (0.49) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL5448142 0.79 MAPT (1.00) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11161160 0.78 EPHX1 (0.59) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11171201 0.77 EPHX1 (0.67) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11159073 0.77 EPHX1 (0.69) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11105097 0.77 EPHX1 (0.66) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11157014 0.76 EPHX1 (0.56) MAPTALDH1A1SMN1; SMN2NPC1EPHX1
SCHEMBL11163863 0.76 EPHX1 (0.65) MAPTALDH1A1SMN1; SMN2NPC1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0017484-B1 2-IMIDAZOLINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITION OF THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-04-06 — — EP disclosed
EP-0017484-A1 2-Imidazoline derivatives, process for the preparation thereof and the pharmaceutical composition of the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-10-15 — — EP disclosed
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