SCHEMBL9689891

SCHEMBL9689891

CCCNc1c(Cl)cnnc1Cl

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 1/20 0.33
LATS1 O95835 1/20 0.31
PKM P14618 1/20 0.31
RAD52 P43351 1/20 0.31
PDE10A Q9Y233 1/20 0.31
NR1I2 O75469 1/20 0.31
AHR P35869 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK14 Q16539 1/20 0.31
LIMK1 P53667 1/20 0.30
CNR2 P34972 2/20 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
SCHEMBL18227479 0.85 LMNA (0.33)
SCHEMBL7406390 0.73 ALDH1A1 (0.41) KMT2A
SCHEMBL29284658 0.72
SCHEMBL31256687 0.71 PTGER4 (0.36) PKMPDE10AKMT2A
SCHEMBL15793540 0.71 ALDH1A1 (0.37) LATS1PKMRAD52PDE10A
SCHEMBL23234819 0.70 KMT2A (0.45) RAD52KMT2A
SCHEMBL23341539 0.70
SCHEMBL17376450 0.68 CNR1 (0.46) KMT2ACNR2
SCHEMBL11635902 0.67 PDE10A (0.31) PDE10AKMT2A
SCHEMBL7560933 0.66 TDP1 (0.45) NR1I2AHRKMT2A

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
EP-0507861-A1 DIAROMATIC SUBSTITUTED ANTI-AIDS COMPOUNDS. UPJOHN CO (US) 1992-10-14 EP disclosed