SCHEMBL10907705

SCHEMBL10907705

CCNC(=O)N(C(=N)N)c1c(C)cc(OC)c(OC)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
ESR1 P03372 1/20 0.35
PGR P06401 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
PTGS1 P23219 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
OPRM1 P35372 1/20 0.35
KCNH2 Q12809 1/20 0.35
PTAFR P25105 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 2/20 0.34
RAB9A P51151 1/20 0.34
FKBP5 Q13451 1/20 0.34
LMNA P02545 2/20 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
SCHEMBL10907684 0.86 ALDH1A1 (0.36) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10906692 0.85 MEN1 (0.39) KMT2AMEN1ALDH1A1KDM4EESR1
SCHEMBL10906409 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL10907913 0.84 TSHR (0.42) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10903886 0.84 LMNA (0.36) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL10907009 0.83 POLB (0.40) KMT2AMEN1ESR1PGRADORA3
SCHEMBL10907002 0.81 SCN9A (0.31) SLC6A2SLC6A4
SCHEMBL10905771 0.81 GRIN2D (0.38) KMT2AMEN1KDM4EPTGS1SMN1; SMN2
SCHEMBL10906685 0.80
SCHEMBL10905773 0.78 PTPN1 (0.42) KMT2AKDM4ESMN1; SMN2RAB9ALMNA

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-4564640-A Amidinoureas substituted in both the urea and amidino nitrogen positions WILLIAM H. RORER, INC. (US) 1986-01-14 US disclosed