SCHEMBL27997223

SCHEMBL27997223

C=C(C)CCC=Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.46
PAM P19021 1/20 0.46
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
HTR2A P28223 3/20 0.43
GLA P06280 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 1/20 0.42
IDO1 P14902 2/20 0.41
ALOX15 P16050 1/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL3108116 0.81 PAM (0.55) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL11762183 0.81 PAM (0.46) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL3108113 0.81 PAM (0.55) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL7643395 0.81 SIGMAR1 (0.46) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL2657085 0.80 CYP3A4 (0.37) GLATDP1CYP3A4ALOX15NPC1
SCHEMBL8089036 0.80 PAM (0.59) SIGMAR1PAMHTR2AGLATDP1
SCHEMBL31678768 0.79 PAM (0.44) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL8115998 0.78 PAM (0.52) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL699686 0.78 PAM (0.52) SIGMAR1PAMHDAC3HDAC4HDAC1
SCHEMBL31678774 0.77 PAM (0.42) SIGMAR1PAMHDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104228292-B Orientation control layer polymers, methods of making the same, and articles comprising the same 陶氏环球技术有限公司 2020-06-19 CN claimed
CN-107459726-B Neutral layer polymers, methods of making the same, and articles comprising the same 陶氏环球技术有限公司 2020-07-14 CN disclosed
CN-104228292-B Orientation control layer polymers, methods of making the same, and articles comprising the same 陶氏环球技术有限公司 2020-06-19 CN disclosed
CN-104228292-A ORIENTATION CONTROL LAYER POLYMERS, METHODS OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME ROHM & HAAS ELECT MAT 2014-12-24 CN disclosed