SCHEMBL8832163

SCHEMBL8832163

Cc1ccc2c(c1)c1nc3ccccc3nc1n2C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 1.00
▸ KMT2A Q03164 6/20 1.00
▸ NR1I2 O75469 1/20 1.00
▸ AHR P35869 1/20 1.00
▸ MAPT P10636 9/20 0.70
▸ KDM4E B2RXH2 8/20 0.70
▸ CASP1 P29466 5/20 0.70
▸ CASP7 P55210 5/20 0.70
▸ HCRTR1 O43613 4/20 0.70
▸ TSHR P16473 5/20 0.57
▸ LMNA P02545 4/20 0.57
▸ CREBBP Q92793 1/20 0.57
▸ RAB9A P51151 2/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ L3MBTL1 Q9Y468 4/20 0.50
▸ NQO2 P16083 1/20 0.50
▸ HPGD P15428 3/20 0.48
▸ THRB P10828 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ MAPK1 P28482 5/20 0.47

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
SCHEMBL8349393 0.83 MEN1 (0.70) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL29282173 0.81 MEN1 (0.68) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL16621922 0.81 MEN1 (0.68) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL5524710 0.80 MAPT (0.70) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL8348445 0.80 KMT2A (0.67) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL11180483 0.79 MEN1 (0.68) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL8832460 0.79 MEN1 (0.65) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL8348744 0.78 KMT2A (0.63) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL9706173 0.78 MAPT (0.64) MEN1KMT2ANR1I2AHRMAPT
SCHEMBL20248920 0.77 MEN1 (0.63) MEN1KMT2ANR1I2AHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5597921-A ANTITUMOR AGENTS, TREATMENT OF LEUKEMIA TAISHO PHARMACEUTICAL CO., LTD. (JP) 1997-01-28 — — US disclosed
EP-0695754-A1 INDOLO 2,3-b]QUINOXALINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1996-02-07 — — EP disclosed
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