SCHEMBL5864547

SCHEMBL5864547

OCCOCCOc1cccc(OCCO)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
ALDH1A1 P00352 3/20 0.57
RECQL P46063 1/20 0.57
KDM4E B2RXH2 4/20 0.50
MAPK1 P28482 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
APP P05067 5/20 0.49
LMNA P02545 2/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
USP2 O75604 1/20 0.45
CYP3A4 P08684 1/20 0.45
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
SLCO1B3 Q9NPD5 1/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.45
ALDH2 P05091 1/20 0.44

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
SCHEMBL48318 0.98 TSHR (0.59) TSHRALDH1A1RECQLKDM4EMAPK1
SCHEMBL48741 0.98 TSHR (0.59) TSHRALDH1A1RECQLKDM4EMAPK1
SCHEMBL22677762 0.92 TSHR (0.55) TSHRALDH1A1RECQLKDM4EMAPK1
SCHEMBL14904489 0.92 TSHR (0.55) TSHRALDH1A1RECQLKDM4EMAPK1
1,4-Butanediol SCHEMBL21064755 0.92 TSHR (0.55) TSHRALDH1A1RECQLKDM4EMAPK1
SCHEMBL22266162 0.92 ALDH1A1 (0.64) TSHRALDH1A1RECQLKDM4EMAPK1
SCHEMBL48418 0.89 ALDH1A1 (0.70) TSHRALDH1A1RECQLMAPK1KMT2A
SCHEMBL25123531 0.88 ALDH1A1 (0.58) TSHRALDH1A1RECQLKDM4EMAPK1
Ethylene Glycol SCHEMBL7206927 0.87 ALDH1A1 (0.67) TSHRALDH1A1RECQLMAPK1KMT2A
SCHEMBL22297162 0.86 TSHR (0.54) TSHRALDH1A1RECQLKDM4EMAPK1

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
JP-4001151-A None JP disclosed
US-7131915-B2 Three-layer-cover golf ball ACUSHNET COMPANY (US) 2006-11-07 US disclosed
US-7015300-B2 Multilayered golf ball and composition ACUSHNET COMPANY (US) 2006-03-21 US disclosed
US-20040235587-A1 Three-layer-cover golf ball JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-25 US disclosed
US-20040010096-A1 Multilayered golf ball and composition ACUSHNET COMPANY 2004-01-15 US disclosed
US-6645091-B2 At least one layer and/or cover formed from polymer containing diisocyanate and ethylene glycol derivative having benzene or cyclohexane ring functionality; improved initial velocity and durability ACUSHNET COMPANY 2003-11-11 US disclosed
US-20020098918-A1 Thermoplastic polyurethane golf ball with improved resiliency JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2002-07-25 US disclosed
JP-H041151-A PRODUCTION OF 1,3-BIS(2-HYDROXYETHOXY)BENZENE MITSUI PETROCHEM IND LTD 1992-01-06 JP disclosed