SCHEMBL11289317

SCHEMBL11289317

CN1c2ccccc2SC1C=CNc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.33
▸ ADRB2 P07550 1/20 0.32
▸ ALDH1A1 P00352 4/20 0.31
▸ NPSR1 Q6W5P4 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ BCHE P06276 1/20 0.31
▸ NPC1 O15118 3/20 0.31
▸ RAB9A P51151 3/20 0.31
▸ SMN1; SMN2 Q16637 3/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ MAPT P10636 4/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ RECQL P46063 1/20 0.30

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
SCHEMBL31151816 0.79 MAOA (0.39) MAOAADRB2ALDH1A1BCHENPC1
SCHEMBL28820660 0.78 BCHE (0.39) MAOABCHEMAPT
SCHEMBL28820816 0.78 BCHE (0.39) MAOABCHEMAPT
Iodide SCHEMBL31147101 0.76 MTNR1A (0.37) TDP1BCHESMN1; SMN2MAPTMEN1
SCHEMBL31231848 0.74 APP (0.40) MAOASMN1; SMN2
SCHEMBL27516784 0.74 MAOA (0.41) MAOAALDH1A1BCHENPC1RAB9A
SCHEMBL27870759 0.73 MAOA (0.39) MAOAALDH1A1RAB9ASMN1; SMN2MAPT
SCHEMBL27987207 0.73 MAOA (0.39) MAOAALDH1A1TDP1BCHENPC1
SCHEMBL30846519 0.73 GSK3B (0.42) MAOAALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL10971192 0.72 PDGFRB (0.33) MAOAADRB2ALDH1A1NPSR1TDP1

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-0050558-A2 Photographic emulsions and elements capable of forming direct-positive images EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1982-04-28 — — EP disclosed
Send feedback