SCHEMBL28471916

SCHEMBL28471916

CCc1cccc(Sc2ccccc2N=C=O)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.43
▸ CYP3A4 P08684 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ GABRA1 P14867 1/20 0.38
▸ GABRB2 P47870 1/20 0.38
▸ SLC6A2 P23975 3/20 0.35
▸ SLC6A4 P31645 3/20 0.35
▸ SLC6A3 Q01959 2/20 0.35
▸ SIGMAR1 Q99720 6/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ TP53 P04637 1/20 0.32
▸ MGLL Q99685 1/20 0.31

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
SCHEMBL28475405 0.89 HPGD (0.41) HPGDCYP3A4PRMT1GABRA1GABRB2
SCHEMBL28481093 0.87 HPGD (0.40) HPGDCYP3A4PRMT1GABRA1GABRB2
SCHEMBL10979160 0.82 GABRA1 (0.39) HPGDCYP3A4GABRA1GABRB2SLC6A2
SCHEMBL17847474 0.82 GABRA1 (0.36) HPGDCYP3A4GABRA1GABRB2SLC6A2
SCHEMBL28479110 0.81 CYP3A4 (0.47) HPGDCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL17847452 0.81 CYP3A4 (0.42) HPGDCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL624408 0.78 CYP3A4 (0.44) HPGDCYP3A4
SCHEMBL28467702 0.78 SLC6A2 (0.50) HPGDCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL28470449 0.78 CYP3A4 (0.40) HPGDCYP3A4SLC6A2SLC6A4SLC6A3
SCHEMBL10985009 0.78 CYP3A4 (0.37) HPGDCYP3A4GABRA1GABRB2SLC6A2

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-107223121-B Wet stable holographic media 科思创德国股份有限公司 2020-10-27 — — CN disclosed
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