SCHEMBL10752980

SCHEMBL10752980

CC(CN1C(=O)c2ccccc2C1=O)c1c[nH]c2ccc(Br)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 1/20 0.46
▸ SRC P12931 1/20 0.45
▸ MAPT P10636 6/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 1/20 0.43
▸ GAA P10253 2/20 0.42
▸ PRMT5 O14744 1/20 0.42
▸ WDR77 Q9BQA1 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CAMK2D Q13557 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ HTR2B P41595 1/20 0.40

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
SCHEMBL10754099 0.84 HTR2A (0.44) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10754767 0.83 GAA (0.42) MAPTMEN1KMT2ALMNAHTT
SCHEMBL18235618 0.80 KMT2A (0.40) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10756653 0.79 HTR1D (0.39) SRCMAPTMEN1KMT2ALMNA
SCHEMBL18222538 0.77 HTR1A (0.41) MAPTMEN1KMT2ALMNAGAA
SCHEMBL15092407 0.76 ALDH1A1 (0.44) MAPTPRMT5WDR77RAB9AALDH1A1
SCHEMBL15092409 0.76 ALDH1A1 (0.44) MAPTPRMT5WDR77RAB9AALDH1A1
SCHEMBL12279346 0.76 ALDH1A1 (0.44) MAPTPRMT5WDR77RAB9AALDH1A1
SCHEMBL8913853 0.74 GAA (0.73) MAPTMEN1KMT2ALMNAHTT
SCHEMBL10758547 0.74 HTR2A (0.65) CCKBRSRCHTR2AHTR2CHTR2B

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
US-4636521-A ANALGESICS GLAXO GROUP LIMITED (GB) 1987-01-13 — — US disclosed
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