SCHEMBL30516294

SCHEMBL30516294

Nc1ccc(-c2cc(-c3ccc(N)cc3)c3ccc4c(-c5ccc(N)cc5)cc(-c5ccc(N)cc5)c5ccc2c3c54)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
CA12 O43570 2/20 0.43
CA9 Q16790 2/20 0.43
TAAR1 Q96RJ0 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
DHFR P00374 2/20 0.38
PRKCZ Q05513 1/20 0.38
APP P05067 1/20 0.37
KDR P35968 3/20 0.36
KIT P10721 2/20 0.36
FLT3 P36888 2/20 0.36
USP7 Q93009 1/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35

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
SCHEMBL16424628 1.00 CYP3A4 (0.48) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL23573645 0.91 CYP3A4 (0.40) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL31608421 0.91 CYP3A4 (0.40) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL26106347 0.81 ALDH1A1 (0.62) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL18088201 0.79 PRKCZ (0.47) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL4584768 0.77 BACE1 (0.46) ALDH1A1CA12CA9MEN1MAPT
SCHEMBL25012001 0.76 CYP3A4 (0.43) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL29601161 0.76 CYP3A4 (0.43) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL30629359 0.76 ALDH1A1 (0.56) CYP3A4TDP1ALDH1A1TP53CA12
SCHEMBL4585392 0.75 GRM2 (0.43) ALDH1A1MAPTHSD17B10NPC1RAB9A

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
CN-120005132-A Double-hole covalent organic framework material and preparation method and application thereof 华南理工大学 2025-05-16 CN disclosed
CN-119978278-A D-A covalent organic framework based on asymmetric benzothiadiazole ligand and preparation method and application thereof 山东师范大学 2025-05-13 CN disclosed
CN-119735770-A Covalent organic framework material and preparation method and application thereof 广东工业大学 2025-04-01 CN disclosed
US-20250075040-A1 CO-EVAPORATION OF MONOMER PAIRS FOR COVALENT ORGANIC FRAMEWORK FILM GROWTH WILLIAM MARSH RICE UNIVERSITY (US) 2025-03-06 US disclosed
CN-116375959-A Three-dimensional fluorescence covalent organic framework and preparation method and application thereof 浙江工业大学 2023-07-04 CN disclosed