SCHEMBL9023793

SCHEMBL9023793

Cc1nn2c3ccccc3c(=O)c3c(Br)ccc1c32

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ HTT P42858 2/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ NQO1 P15559 3/20 0.34

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
SCHEMBL9023798 0.83 MAPT (0.41) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL8545260 0.82 MAPT (0.41) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL9023936 0.81 NQO2 (0.34) ALDH1A1MAPTCYP1A2PARP1HTT
SCHEMBL9025389 0.81 KDM1A (0.41) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL8543080 0.80 MAPT (0.35) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL9025371 0.79 CYP1A2 (0.44) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL8548094 0.78 KDM4E (0.39) ALDH1A1KDM4ELMNAMAPTNPC1
SCHEMBL9025257 0.77 KDM4E (0.40) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL9024798 0.75 NQO2 (0.56) ALDH1A1KDM4ELMNANQO1NQO2
SCHEMBL9023664 0.74 KDM4E (0.45) KDM4ELMNAMAPTTP53HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0347749-B1 Pyrazoloacridone derivatives with anti-tumoral activity KYOWA HAKKO KOGYO KK (JP) 1996-04-24 — — EP disclosed
US-5079358-A Humans; leukemia KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-01-07 — — US disclosed
EP-0347749-A2 Pyrazoloacridone derivatives with anti-tumoral activity KYOWA HAKKO KOGYO CO., LTD. (JP) 1989-12-27 — — EP disclosed
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