SCHEMBL30133210

SCHEMBL30133210

Oc1ccc2ccc(CN3CCCC3)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.52
KMT2A Q03164 1/20 0.51
CHKA P35790 1/20 0.51
PKM P14618 1/20 0.50
ALDH1A1 P00352 2/20 0.49
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 1/20 0.49
MAOA P21397 1/20 0.48
HRH4 Q9H3N8 1/20 0.47
MC4R P32245 1/20 0.47
MC5R P33032 1/20 0.47
ACHE P22303 1/20 0.46
KDM4E B2RXH2 1/20 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
SCHEMBL30133222 0.98 HRH3 (0.55) HRH3KMT2ACHKAPKMALDH1A1
SCHEMBL6305023 0.95 HRH3 (0.53) HRH3KMT2ACHKAPKMALDH1A1
Bromide SCHEMBL2924741 0.93 HRH3 (0.52) HRH3KMT2ACHKAPKMALDH1A1
SCHEMBL11268814 0.84 HRH3 (0.53) HRH3KMT2ACHKAPKMALDH1A1
Hydrochloric Acid SCHEMBL11272072 0.83 HRH3 (0.52) HRH3KMT2ACHKAPKMALDH1A1
SCHEMBL31097161 0.80 KMT2A (0.77) HRH3KMT2ACHKAPKMMC4R
SCHEMBL322305 0.79 HRH3 (0.74) HRH3ALDH1A1POLBSMN1; SMN2HRH4
SCHEMBL31010303 0.79 KMT2A (0.74) HRH3KMT2ACHKAPKMALDH1A1
SCHEMBL5195380 0.79 KMT2A (0.74) HRH3KMT2ACHKAPKMALDH1A1
SCHEMBL11274717 0.78 HRH3 (0.71) HRH3

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
CN-115605596-A Compositions and methods for inducible alternative splicing modulation of gene expression 费城儿童医院(US) 2023-01-13 CN disclosed