SCHEMBL9823116

SCHEMBL9823116

Cc1nc2ccc(C(=O)c3ccccc3)cc2nc1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.69
ALDH1A1 P00352 8/20 0.59
RAB9A P51151 6/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
HPGD P15428 3/20 0.59
POLB P06746 2/20 0.59
KDM4E B2RXH2 3/20 0.58
MAPT P10636 3/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
USP2 O75604 2/20 0.58
LMNA P02545 2/20 0.58
RECQL P46063 1/20 0.58
BLM P54132 1/20 0.58
MCL1 Q07820 1/20 0.58
ATM Q13315 1/20 0.52
HTT P42858 3/20 0.51
ABL1 P00519 2/20 0.51
FABP6 P51161 1/20 0.51

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
SCHEMBL15196669 0.86 RAB9A (0.61) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL8764992 0.83 RAB9A (0.58) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL9823073 0.82 RAB9A (0.71) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL31133324 0.82 TDP1 (1.00) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL4348032 0.82 TDP1 (1.00) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL10435576 0.81 ALDH1A1 (0.76) ALDH1A1RAB9ASMN1; SMN2HPGDPOLB
SCHEMBL9822779 0.78 TDP1 (0.72) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL16927680 0.77 ALDH1A1 (0.72) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL10435158 0.77 ALDH1A1 (0.81) ALDH1A1RAB9ASMN1; SMN2HPGDPOLB
SCHEMBL19622430 0.77 TDP1 (0.70) TDP1ALDH1A1RAB9ASMN1; SMN2HPGD

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
EP-0288898-B1 SUBSTITUTED CHINOXALYL-IMIDAZOLIDINE-2,4-DIONES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND PHARMACOLOGICAL PREPARATIONS HOECHST AKTIENGESELLSCHAFT (DE) 1991-08-14 EP disclosed
US-4943576-A ENZYME INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-24 US disclosed