SCHEMBL7783990

SCHEMBL7783990

Cc1ccc2c(c1C)OC(=O)C2C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP2 O95551 1/20 0.32
NSD2 O96028 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PAX8 Q06710 1/20 0.32
TOP2A P11388 1/20 0.32
TP53 P04637 1/20 0.31

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
SCHEMBL7778968 0.81 BRD4 (0.38) ALDH1A1HPGDMEN1KMT2ATP53
SCHEMBL11121407 0.71 HPGD (0.45) ALDH1A1HPGDMEN1KMT2A
SCHEMBL11119594 0.71 HPGD (0.34) ALDH1A1HPGDMEN1KMT2AHSD17B10
SCHEMBL7785811 0.69 GAA (0.33) ALDH1A1
SCHEMBL31492697 0.69 GAA (0.33) KDM4EALDH1A1HPGDTDP2NSD2
SCHEMBL7785533 0.69 CA2 (0.35) ALDH1A1
SCHEMBL7778979 0.68 HTR2B (0.38) ALDH1A1ALOX15
SCHEMBL21889685 0.66 HTR2C (0.41) HPGDMEN1KMT2ATP53
SCHEMBL31409184 0.65 ALDH1A1 (0.46) ALDH1A1MEN1KMT2A
SCHEMBL18952097 0.65 ALDH1A1 (0.46) ALDH1A1MEN1KMT2A

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
EP-0707575-B1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH & CIE (CH) 2001-10-24 EP claimed
US-5679634-A Use of dihydrobenzofuranones as perfuming ingredients FIRMENICH S.A. (CH) 1997-10-21 US claimed
EP-0707575-A1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH SA (CH) 1996-04-24 EP claimed
WO-1995030667-A1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH S.A. (CH) 1995-11-16 WO claimed
EP-0707575-B1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH & CIE (CH) 2001-10-24 EP disclosed
US-5679634-A Use of dihydrobenzofuranones as perfuming ingredients FIRMENICH S.A. (CH) 1997-10-21 US disclosed
US-5665697-A Use of 1 (3H)-isobenzofuranone in perfumery INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1997-09-09 US disclosed
EP-0707575-A1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH SA (CH) 1996-04-24 EP disclosed
WO-1995030667-A1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH S.A. (CH) 1995-11-16 WO disclosed