SCHEMBL11154642

SCHEMBL11154642

NC(=S)Nc1cc(N2CCCC2)ccc1Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAPT P10636 6/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ GAA P10253 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CSF1R P07333 1/20 0.39
▸ ALOX12 P18054 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ GBA1 P04062 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ TP53 P04637 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
SCHEMBL11154781 0.89 NTRK1 (0.49) MEN1KMT2ANPSR1LMNAMAPT
SCHEMBL11163790 0.83 ALDH1A1 (0.57) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL11170685 0.77 NPSR1 (0.50) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL11170669 0.76 NPSR1 (0.71) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL11163831 0.76 MAPT (0.49) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL11161437 0.75 ALDH1A1 (0.49) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL7815135 0.75 ADRA2C (0.59) MEN1KMT2ANPSR1LMNAL3MBTL1
SCHEMBL11154017 0.74 MAPT (0.65) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL11161355 0.74 PARP10 (0.51) NPSR1LMNAL3MBTL1MAPTSMN1; SMN2
SCHEMBL11168538 0.73 MAPT (0.46) MEN1KMT2ANPSR1LMNAL3MBTL1

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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