SCHEMBL29202682

SCHEMBL29202682

Cc1ccc2nc3c(cc2c1)c1ccccc1n3C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ NR1I2 O75469 1/20 0.56
▸ AHR P35869 1/20 0.56
▸ PDE2A O00408 1/20 0.48
▸ PDE3B Q13370 1/20 0.48
▸ PDE3A Q14432 1/20 0.48
▸ KDM4E B2RXH2 8/20 0.46
▸ LMNA P02545 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ GPR3 P46089 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.43
▸ NQO2 P16083 2/20 0.43
▸ ALKBH5 Q6P6C2 1/20 0.42
▸ FTO Q9C0B1 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ TSHR P16473 1/20 0.42

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
SCHEMBL30888893 1.00 MEN1 (0.56) MEN1KMT2ANR1I2AHRPDE2A
SCHEMBL9394688 0.84 KDM4E (0.59) MEN1KMT2ANR1I2AHRPDE2A
SCHEMBL29282173 0.82 MEN1 (0.68) MEN1KMT2ANR1I2AHRPDE2A
SCHEMBL29202709 0.81 ALDH1A1 (0.57) MEN1KMT2APDE2APDE3BPDE3A
SCHEMBL29202622 0.75 ACHE (0.46) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL20370885 0.73 GPR3 (0.53) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL29282175 0.73 ALKBH5 (0.50) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL8832163 0.72 MEN1 (1.00) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL16625722 0.71 GPR3 (0.50) MEN1KMT2ANR1I2AHRKDM4E
SCHEMBL12249979 0.71 ALKBH5 (0.56) MEN1KMT2ANR1I2AHRKDM4E

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
CN-117946104-A Preparation method of iodine-mediated indolo [2,3-b ] quinoline compound in water phase 山东第二医科大学 2024-04-30 — — CN disclosed
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