SCHEMBL27732171

SCHEMBL27732171

CC1=NN(c2ccccc2F)C(C=O)C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 2/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ GLA P06280 1/20 0.36
▸ TNKS2 Q9H2K2 2/20 0.36
▸ MAPT P10636 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL28770717 0.80 KDM4E (0.35) HSD17B10ALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL27995323 0.80 TERT (0.34) TERTALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL25178380 0.78 MAPT (0.48) TERTALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL27712033 0.76 MAPT (0.38) TERTALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL28774862 0.75 LMNA (0.39) HSD17B10SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL28897005 0.73 HSD17B10 (0.41) TERTHSD17B10ALDH1A1SMN1; SMN2KDM4E
SCHEMBL27447779 0.73 CD274 (0.46) TERTHSD17B10ALDH1A1SMN1; SMN2KDM4E
SCHEMBL27692022 0.72 PRKCZ (0.45) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL28436430 0.72 MAPT (0.40) TERTALDH1A1SMN1; SMN2KDM4ETDP1
SCHEMBL28158503 0.70 TERT (0.35) TERTALDH1A1SMN1; SMN2KMT2AMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101243050-B Pyrazolone derivatives HOFFMANN LA ROCHE 2012-07-04 — — CN disclosed
CN-101243050-A Pyrazolone derivatives HOFFMANN LA ROCHE (CH) 2008-08-13 — — CN disclosed
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