SCHEMBL8464466

SCHEMBL8464466

O=C(CC1CC2C=CC1C2)CC1CC2C=CC1C2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 3/20 0.42
TDP1 Q9NUW8 3/20 0.41
EPHX2 P34913 2/20 0.40
PKM P14618 2/20 0.38
TSHR P16473 1/20 0.37
POLB P06746 1/20 0.35
ALOX15 P16050 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
SCHEMBL4743500 0.88 KDM4E (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL6909707 0.87 KDM4E (0.38) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL29116614 0.87 KDM4E (0.41) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL4783612 0.85 KDM4E (0.42) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL23694121 0.85 SLC6A12 (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL75258 0.85 SLC6A12 (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL17331216 0.85 SLC6A12 (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL560786 0.85 SLC6A12 (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL17934358 0.85 SLC6A12 (0.45) KDM4ELMNAALDH1A1TDP1EPHX2
SCHEMBL3760676 0.85 KDM4E (0.47) KDM4ELMNAALDH1A1TDP1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5936048-A Method for preparing modified resins and their applications MITSUI CHEMICALS, INC. (JP) 1999-08-10 US disclosed
EP-0698620-B1 Method for preparing modified resins and their applications MITSUI CHEMICALS INC (JP) 1998-12-09 EP disclosed
US-5792814-A REACTING A RESIN WITH A 5-((4,6-DIAMINO-S-TRIAZIN-2-YL)-NORBORN-2-ENE AND REACTING WITH AN EPOXIDE; FIREPROOFING; MOLDING MATERIALS MITSUI CHEMICALS, INC. (JP) 1998-08-11 US disclosed
EP-0698620-A1 Method for preparing modified resins and their applications MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-02-28 EP disclosed
US-4033748-A MICROBIOCIDES MERCK & CO., INC. (US) 1977-07-05 US disclosed