SCHEMBL9712460

SCHEMBL9712460

Cc1cccc(C(=O)Cl)c1C(=O)c1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.51
CDC25B P30305 2/20 0.50
CNR2 P34972 11/20 0.49
CNR1 P21554 9/20 0.49
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
NR1I2 O75469 1/20 0.49
CYP1A2 P05177 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
CYP2C19 P33261 1/20 0.49
KMT2A Q03164 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
NR4A1 P22736 1/20 0.47
NR4A2 P43354 1/20 0.47
NR4A3 Q92570 1/20 0.47
PLK1 P53350 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
Hydrochloric Acid SCHEMBL8181527 0.88 BCL2L1 (0.43) BCL2L1CDC25BCNR2CNR1ALDH1A1
SCHEMBL6238903 0.82 BCL2L1 (0.55) BCL2L1CDC25BCNR2CNR1ALDH1A1
SCHEMBL9712387 0.81 ALDH1A1 (0.50) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL27321464 0.80 AKR1C3 (0.46) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL17060508 0.80 CDC25B (0.70) CDC25BCNR2CNR1MEN1MAPT
SCHEMBL7915709 0.80 CDC25B (0.65) BCL2L1CDC25BCNR2CNR1ALDH1A1
SCHEMBL9712609 0.79 ALDH1A1 (0.59) ALDH1A1MEN1MAPTKMT2ARAB9A
SCHEMBL29808434 0.79 NR4A1 (0.65) CDC25BCNR2CNR1ALDH1A1MEN1
SCHEMBL123694 0.79 NR4A1 (0.65) CDC25BCNR2CNR1ALDH1A1MEN1
SCHEMBL27755163 0.79 NR4A1 (0.65) CDC25BCNR2CNR1ALDH1A1MEN1

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
US-5117057-A Insecticidal N' substituted-N-N'-disubstituted-hydrazines ROHM AND HAAS COMPANY (US) 1992-05-26 US disclosed