SCHEMBL11241827

SCHEMBL11241827

CC1=CC(=O)C(N)=C(C)C1=N

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EEF2K O00418 1/20 0.31
▸ PLK1 P53350 1/20 0.31
▸ PLK2 Q9NYY3 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ PLIN1 O60240 1/20 0.30
▸ NR1I2 O75469 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GSR P00390 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HSPD1 P10809 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ PKM P14618 1/20 0.30

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
SCHEMBL11658103 0.67 MAPT (0.41) EEF2KPLK1PLK2MEN1PLIN1
SCHEMBL11407551 0.65 — —
SCHEMBL11237515 0.65 SLC2A1 (0.41) EEF2KPLK1PLK2MEN1PLIN1
SCHEMBL11685820 0.65 — —
SCHEMBL18213696 0.65 — —
SCHEMBL10787081 0.64 DDAH1 (0.33) MEN1USP2ALDH1A1TP53CYP3A4
SCHEMBL11231207 0.64 SLC2A1 (0.31) MEN1PLIN1NR1I2USP2ALDH1A1
SCHEMBL10788045 0.62 NPC1 (0.33) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL7050442 0.62 — —
P-Xyloquinone SCHEMBL49964 0.61 PLK1 (0.60) EEF2KPLK1PLK2MEN1PLIN1

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
US-4361516-A N-Monosubstituted indoanilines SOCIETE ANONYME DITE: L'OREAL (FR) 1982-11-30 — — US disclosed
US-4008043-A Diphenylamines for dyeing keratinic fibers L'OREAL (FR) 1977-02-15 — — US disclosed
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