SCHEMBL18535188

SCHEMBL18535188

CC1Nc2ccccc2N1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 2/20 0.55
▸ LMNA P02545 2/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ BRD4 O60885 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ EHMT2 Q96KQ7 1/20 0.40
▸ PTPN1 P18031 1/20 0.39
▸ HDAC2 Q92769 3/20 0.39
▸ HDAC8 Q9BY41 3/20 0.39
▸ HDAC6 Q9UBN7 3/20 0.39
▸ ACHE P22303 1/20 0.39
▸ ATM Q13315 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
SCHEMBL18535193 0.81 HTT (0.47) ALOX12LMNAMAPK1ALDH1A1KDM4E
SCHEMBL7498201 0.81 LMNA (0.49) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL25121378 0.80 LMNA (0.45) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL14566671 0.80 LMNA (0.45) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL5199567 0.79 LMNA (0.48) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL22726442 0.79 ALOX12 (0.48) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL19015565 0.77 LMNA (0.39) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL18844475 0.74 BRD4 (0.53) ALOX12LMNAMAPK1BRD4EHMT2
SCHEMBL10288823 0.74 PTPN1 (0.46) ALOX12LMNAMAPK1BRD4ALDH1A1
SCHEMBL19997193 0.74 PTPN1 (0.46) ALOX12LMNAMAPK1BRD4ALDH1A1

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-2083819-B1 PDE10 INHIBITORS AND RELATED COMPOSITIONS AND METHODS OMEROS CORP (US) 2017-02-22 — — EP disclosed
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