SCHEMBL9576014

SCHEMBL9576014

C=C(CC1(CC)C(=O)c2ccccc2C1=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 4/20 0.39
PKM P14618 1/20 0.39
MEN1 O00255 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
APAF1 O14727 1/20 0.38
TDP2 O95551 1/20 0.38
NSD2 O96028 1/20 0.38
ABL1 P00519 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
CASP3 P42574 1/20 0.38
HTT P42858 1/20 0.38
GALK1 P51570 1/20 0.38
BLM P54132 1/20 0.38
PPP1CA P62136 1/20 0.38
RIN1 Q13671 1/20 0.38
SENP8 Q96LD8 1/20 0.38

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
SCHEMBL9421601 0.84 MAPT (0.45) MAPTALDH1A1KMT2APKMMEN1
SCHEMBL7967035 0.76 ALDH1A1 (0.48) MAPTALDH1A1KMT2APKMMEN1
SCHEMBL9421595 0.72 KDM4E (0.41) MAPTALDH1A1KDM4EGAAMAOA
SCHEMBL9421589 0.70 KCNA3 (0.38) MAPTALDH1A1KDM4EHSP90AA1HSP90AB1
SCHEMBL9010137 0.70 ELANE (0.42) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL14958 0.66 MAOA (0.52) MAPTALDH1A1MAOAMAOB
SCHEMBL8366982 0.66 MAPT (0.47) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL10356412 0.66 CYP3A4 (0.43) MAPTALDH1A1KMT2AMEN1HTT
SCHEMBL9575978 0.65 MAPT (0.38) MAPTALDH1A1KMT2APKML3MBTL1
SCHEMBL6546362 0.65 MAOA (0.42) MAPTALDH1A1SMN1; SMN2MAOAMAOB

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-0398258-B1 INDAN-1,3-DIONE DERIVATIVE AND HERBICIDAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT MITSUBISHI KASEI CORPORATION (JP) 1993-08-04 EP disclosed
US-5110342-A INDAN-1,3-DIONE DERIVATIVE AND HERBICIDAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT MITSUBISHI KASEI CORPORATION (JP) 1992-05-05 US disclosed
US-5076830-A INDAN-1,3-DIONE DERIVATIVE AND HERBICIDAL COMPOSITION CONTAINING THE SAME AS ACTIVE INGREDIENT MITSUBISHI KASEI CORPORATION (JP) 1991-12-31 US disclosed