SCHEMBL19253342

SCHEMBL19253342

Nc1cc2cc3c4cc5ccccc5cc4c4cc5ccccc5cc4c3cc2c(N)c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.41
IDO1 P14902 1/20 0.39
ALDH1A1 P00352 7/20 0.38
POLB P06746 4/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 3/20 0.38
GAA P10253 3/20 0.38
RCE1 Q9Y256 2/20 0.38
NPC1 O15118 2/20 0.38
GLA P06280 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
PTBP1 P26599 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 5/20 0.38
CYP3A4 P08684 4/20 0.38
TSHR P16473 1/20 0.38
KEAP1 Q14145 1/20 0.38
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37

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
SCHEMBL3317872 0.93 ALDH1A1 (0.43) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL19253219 0.81 ALDH1A1 (0.44) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL31281983 0.79 ALDH1A1 (0.48) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL29463710 0.79 ALDH1A1 (0.48) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL677653 0.79 ALDH1A1 (0.48) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL22776396 0.79 ALDH1A1 (0.50) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL27763980 0.77 ALDH1A1 (0.44) HPRT1ALDH1A1POLBKDM4EHPGD
SCHEMBL2321929 0.76 ALDH1A1 (0.48) HPRT1IDO1ALDH1A1POLBKDM4E
SCHEMBL10326065 0.73 ALDH1A1 (0.48) HPRT1ALDH1A1POLBKDM4EHPGD
SCHEMBL139321 0.72 CYP3A4 (0.55) HPRT1IDO1ALDH1A1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250026889-A1 TWO DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS U.S. GOVERNMENT, AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2025-01-23 US disclosed
US-12110367-B2 Two-dimensional polymers comprised of a combination of stiff and compliant molecular units THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2024-10-08 US disclosed
US-20200148827-A1 TWO-DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2020-05-14 US disclosed
US-10590241-B2 Two-dimensional polymers comprised of a combination of stiff and compliant molecular units THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2020-03-17 US disclosed
US-20170240706-A1 TWO-DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS ARMY, UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE 2017-08-24 US disclosed