SCHEMBL26038211

SCHEMBL26038211

CC#Cc1cc2nc(N(CCC)CCC)nc(N)c2cc1OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
KMT2A Q03164 2/20 0.48
GLA P06280 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
SMARCA2 P51531 1/20 0.48
EHMT2 Q96KQ7 2/20 0.42
EHMT1 Q9H9B1 2/20 0.42
MEN1 O00255 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PDE1B Q01064 1/20 0.39
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38

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
SCHEMBL11871051 0.74 LMNA (0.68) LMNAKMT2AGLAPOLBGAA
SCHEMBL13941828 0.74 LMNA (0.68) LMNAKMT2AGLAPOLBGAA
SCHEMBL11160942 0.68 KMT2A (0.55) LMNAKMT2AGLAPOLBGAA
SCHEMBL4689994 0.67 MAP4K4 (0.39) PDE1B
SCHEMBL6784767 0.67 ADRA1D (0.46) EHMT2EHMT1ADRA1DADRA1AADRA1B
SCHEMBL6780798 0.67 KDM4E (0.48) LMNAGLAGAAADRA1DADRA1A
SCHEMBL11046169 0.67 POLB (0.97) LMNAKMT2AGLAPOLBGAA
SCHEMBL21227155 0.66 DCPS (0.49) KMT2AGLAGAAMEN1ADRA1A
Hydrochloric Acid SCHEMBL3637603 0.66 POLB (1.00) LMNAKMT2AGLAPOLBGAA
SCHEMBL3103845 0.65 LMNA (0.61) LMNAKMT2AGLAPOLBGAA

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-4230624-A1 QUINAZOLINE-2,4-DIAMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT The Asan Foundation (KR) 2023-08-23 EP disclosed