SCHEMBL11260929

SCHEMBL11260929

Cc1c(NC(=N)NC(=O)NC(C)(C)C)ccc(Cl)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ HTT P42858 2/20 0.42
▸ POLB P06746 4/20 0.41
▸ LMNA P02545 2/20 0.35
▸ PDGFRB P09619 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ CXCR2 P25025 2/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33

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
SCHEMBL11059010 0.90 MEN1 (0.55) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11265410 0.85 KMT2A (0.56) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11262102 0.83 MAPK1 (0.43) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11052077 0.83 MEN1 (0.74) KMT2AMAPK1MEN1POLBLMNA
SCHEMBL11050902 0.83 MAPK1 (0.49) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11059026 0.82 RAB9A (0.47) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11250511 0.81 CYP1A2 (0.40) KMT2AMAPK1MEN1POLBLMNA
SCHEMBL11053981 0.81 PDK1 (0.50) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11052114 0.81 PDK1 (0.50) KMT2AMAPK1MEN1HTTPOLB
SCHEMBL11249398 0.80 MAPK1 (0.41) KMT2AMAPK1MEN1HTTPOLB

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
US-4326074-A ANTIDIARRHEA AGENTS WILLIAM H. RORER, INC. (US) 1982-04-20 — — US disclosed
Send feedback