SCHEMBL28103275

SCHEMBL28103275

NCc1cccc(N2CCC(C=O)N2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.37
▸ ALOX5 P09917 2/20 0.36
▸ NCF1 P14598 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ KLKB1 P03952 1/20 0.33
▸ PNMT P11086 1/20 0.33
▸ ENPP2 Q13822 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.32
▸ AGXT P21549 1/20 0.32

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
SCHEMBL27505117 0.86 DDB1 (0.31) DDB1CRBNHRH3
SCHEMBL27873899 0.85 SLC6A2 (0.38) ALOX5
SCHEMBL27743313 0.80 ALOX5 (0.48) ALOX5LMNA
SCHEMBL28103502 0.79 ALOX5 (0.47) ALOX5
SCHEMBL27873897 0.79 ALOX5 (0.47) ALOX5
SCHEMBL27671224 0.78 ALOX5 (0.41) ALOX5
SCHEMBL28835067 0.77 ALOX5 (0.49) ALOX5
SCHEMBL28103278 0.76 CALML3 (0.31) —
SCHEMBL28103538 0.72 NCF1 (0.38) ALOX5NCF1
SCHEMBL28103613 0.71 MGLL (0.37) LMNADDB1CRBN

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-106061950-A Method for producing pyrazole compound 住友化学株式会社 2016-10-26 — — CN disclosed
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