SCHEMBL4967660

SCHEMBL4967660

NC1CCCc2c1n(-c1ccccc1)c1ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TBXA2R P21731 1/20 0.39
▸ PTGDR Q13258 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.38
▸ IL1R1 P14778 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CA1 P00915 3/20 0.35
▸ CA2 P00918 3/20 0.35
▸ CASP1 P29466 2/20 0.35

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
SCHEMBL4968337 0.84 MAPT (0.44) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL4970714 0.83 MEN1 (0.40) L3MBTL1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL5513518 0.80 MEN1 (0.45) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL4972027 0.74 MAPT (0.46) KDM4EALDH1A1MEN1KMT2AHSD17B10
SCHEMBL25104929 0.73 KDM4E (0.44) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL11940495 0.72 CA1 (0.54) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL7427782 0.71 CA1 (0.55) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL4968907 0.71 HTR6 (0.41) ALDH1A1MEN1KMT2AHSD17B10TBXA2R
SCHEMBL19311768 0.71 ALDH1A1 (0.36) KDM4EL3MBTL1ATMALDH1A1MEN1
SCHEMBL4966957 0.71 KDM4E (0.45) KDM4EALDH1A1MEN1KMT2AHSD17B10

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-1654228-B1 TETRAHYDROCARBAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM CORP (US) 2008-10-22 — — EP claimed
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