SCHEMBL4623293

SCHEMBL4623293

CC(C)=CCCC(C)C[C](Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALOX15 P16050 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NFE2L2 Q16236 1/20 0.39
SRC P12931 1/20 0.36
MSR1 P21757 1/20 0.36
TRPV1 Q8NER1 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4940586 0.79 ALOX15 (0.52) ATMTDP1L3MBTL1ALOX15ALDH1A1
Citronellol SCHEMBL28238103 0.77 ALOX15 (0.58) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL2128780 0.76 MEN1 (0.56) ATMTDP1L3MBTL1ALDH1A1TRPV1
SCHEMBL874243 0.75 ALOX15 (0.58) ATMTDP1L3MBTL1ALOX15ALDH1A1
Citronellol SCHEMBL17580723 0.74 ALOX15 (0.64) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL16053089 0.74 MAOB (0.46) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL9955023 0.74 MAOB (0.46) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL11617690 0.74 ACE (0.47) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL7930882 0.73 ALOX15 (0.49) ATMTDP1L3MBTL1ALOX15ALDH1A1
SCHEMBL11617683 0.73 ATM (0.42) ATMTDP1L3MBTL1ALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977548-B2 FRAGRANCE PRO-ACCORDS PROCTER & GAMBLE (US) 2008-03-26 EP disclosed
EP-0977548-B1 FRAGRANCE PRO-ACCORDS PROCTER & GAMBLE (US) 2004-08-18 EP disclosed
US-6114302-A STABILITY THE PROCTER & GAMBLE COMPANY (US) 2000-09-05 US disclosed
US-6087322-A Fragrance pro-accords THE PROCTER & GAMBLE COMPANY (US) 2000-07-11 US disclosed
US-6077821-A FOR USE IN DELIVERING SUSTAINED RELEASE OR ENHANCED LONGEVITY FRAGRANCES TO A VARIETY OF PERSONAL CARE AND PERSONAL HYGIENE PRODUCTS INTER ALIA DEODORANTS, BODY LOTIONS OR CREAMS, AND SHAMPOOS THE PROCTER & GAMBLE COMPANY (US) 2000-06-20 US disclosed
EP-0977548-A1 FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 2000-02-09 EP disclosed
WO-1998047996-A1 LAUNDRY DETERGENT COMPOSITIONS COMPRISING FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO disclosed
WO-1998047477-A1 FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO disclosed