SCHEMBL5524587

SCHEMBL5524587

CCOC(=O)c1ccc(N2C(=O)C3C4C=CC(C4)C3C2=O)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.76
ATM Q13315 1/20 0.63
HPGD P15428 5/20 0.59
NPSR1 Q6W5P4 4/20 0.59
KDM4E B2RXH2 3/20 0.59
MAPK1 P28482 2/20 0.59
HTT P42858 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
HSP90AA1 P07900 1/20 0.58
CACNA1B Q00975 1/20 0.58
APBA1 Q02410 1/20 0.58
TSHR P16473 3/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
KMT2A Q03164 3/20 0.57
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
MEN1 O00255 1/20 0.53
USP2 O75604 1/20 0.53
MAPT P10636 1/20 0.53
ALOX12 P18054 1/20 0.53

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
SCHEMBL14494335 0.89 ALDH1A1 (0.62) ALDH1A1ATMHPGDNPSR1KDM4E
SCHEMBL13318217 0.85 ALDH1A1 (0.66) ALDH1A1HPGDNPSR1MAPK1HTT
SCHEMBL13483824 0.84 ALDH1A1 (0.58) ALDH1A1ATMHPGDNPSR1KDM4E
SCHEMBL5515220 0.83 SMN1; SMN2 (0.58) ALDH1A1ATMHPGDNPSR1KDM4E
SCHEMBL5524642 0.83 POLB (0.60) ALDH1A1ATMHPGDNPSR1KDM4E
SCHEMBL13477975 0.81 KMT2A (0.67) ALDH1A1KMT2ACA1CA2USP2
SCHEMBL9967356 0.80 KMT2A (0.85) ALDH1A1NPSR1TDP1TSHRKMT2A
SCHEMBL20589125 0.80 KMT2A (0.85) ALDH1A1NPSR1TDP1TSHRKMT2A
SCHEMBL14254599 0.80 ALDH1A1 (0.52) ALDH1A1ATMHPGDNPSR1KDM4E
SCHEMBL4867443 0.80 ALDH1A1 (0.52) ALDH1A1ATMHPGDNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-20060189771-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-08-24 US disclosed
US-20060041092-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-02-23 US disclosed
EP-1561766-A1 RING-OPENED POLYNORBORNENES JSR Corporation (JP) 2005-08-10 EP disclosed