SCHEMBL10395175

SCHEMBL10395175

O=C(CI)Oc1ccc(OC(=O)CI)c2c1C(=O)C=CC2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.50
▸ POLM Q9NP87 2/20 0.42
▸ POLK Q9UBT6 2/20 0.42
▸ POLL Q9UGP5 2/20 0.42
▸ POLH Q9Y253 2/20 0.42
▸ TOP1 P11387 6/20 0.38
▸ AURKA O14965 1/20 0.35
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CDC25B P30305 1/20 0.35
▸ TXNRD1 Q16881 1/20 0.35
▸ TXNRD3 Q86VQ6 1/20 0.35
▸ COPS5 Q92905 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ TXNRD2 Q9NNW7 1/20 0.35
▸ ALOX15 P16050 5/20 0.33
▸ NQO1 P15559 1/20 0.33
▸ ERBB2 P04626 1/20 0.31
▸ HKDC1 Q2TB90 1/20 0.31
▸ MEN1 O00255 1/20 0.30

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
SCHEMBL10395154 0.83 POLM (0.63) PIM1POLMPOLKPOLLPOLH
SCHEMBL10395028 0.81 PIM1 (0.50) PIM1POLMPOLKPOLLPOLH
SCHEMBL10378556 0.74 PIM1 (0.82) PIM1POLMPOLKPOLLPOLH
SCHEMBL6693604 0.73 ALDH1A1 (0.42) ALOX15MEN1ALDH1A1TP53MAPT
SCHEMBL8080598 0.68 KDM4E (0.43) POLMPOLKPOLLPOLHTOP1
SCHEMBL9006594 0.68 PIM1 (0.49) PIM1POLMPOLKPOLLPOLH
SCHEMBL10394363 0.66 POLM (0.63) PIM1POLMPOLKPOLLPOLH
SCHEMBL3054875 0.66 POLM (0.63) PIM1POLMPOLKPOLLPOLH
SCHEMBL22279459 0.65 KDM4E (0.36) CYP1A2ALOX15MEN1USP2ALDH1A1
SCHEMBL22374145 0.65 CES2 (0.33) ALOX15

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-4900737-A ANTICANCER AGENTS GLAXO GROUP LIMITED (GB) 1990-02-13 — — US disclosed
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