SCHEMBL11059010

SCHEMBL11059010

CC(C)(C)NC(=O)NC(=N)Nc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ HTT P42858 2/20 0.43
▸ POLB P06746 2/20 0.41
▸ MAPK14 Q16539 3/20 0.36
▸ CXCR2 P25025 2/20 0.36
▸ PDK1 Q15118 1/20 0.36
▸ PDK2 Q15119 1/20 0.36
▸ PDK3 Q15120 1/20 0.36
▸ PDK4 Q16654 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PDGFRB P09619 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 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
SCHEMBL11260929 0.90 KMT2A (0.50) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11052077 0.87 MEN1 (0.74) MEN1KMT2AMAPK1POLBMAPK14
SCHEMBL11050902 0.84 MAPK1 (0.49) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11053981 0.82 PDK1 (0.50) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11052114 0.82 PDK1 (0.50) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11262102 0.82 MAPK1 (0.43) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11052475 0.81 POLB (0.61) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11052904 0.81 HTT (0.47) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11059026 0.81 RAB9A (0.47) MEN1KMT2AMAPK1HTTPOLB
SCHEMBL11053819 0.80 KMT2A (0.46) MEN1KMT2AMAPK1HTTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4488993-A Amidinoureas WILLIAM H. RORER, INC. 1984-12-18 — — US disclosed
US-4220658-A Treatment of hypertension with amidinoureas WILLIAM H. RORER, INC. (US) 1980-09-02 — — US disclosed
US-4088785-A HYPOTENSIVE AGENTS WILLIAM H. RORER, INC. (US) 1978-05-09 — — US disclosed
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