SCHEMBL887955

SCHEMBL887955

COC=Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
TRPV1 Q8NER1 7/20 0.43
TSHR P16473 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 3/20 0.39
TYR P14679 1/20 0.39
GRIN2D O15399 2/20 0.39
GRIN3B O60391 2/20 0.39
GRIN1 Q05586 2/20 0.39
GRIN2A Q12879 2/20 0.39
GRIN2B Q13224 2/20 0.39
GRIN2C Q14957 2/20 0.39
GRIN3A Q8TCU5 2/20 0.39
HPGD P15428 2/20 0.38

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
SCHEMBL1825729 0.81 CYP1A2 (0.64) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL1825727 0.81 CYP1A2 (0.64) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL3119513 0.81 PTGS1 (0.53) CYP1A2CA1CA2
SCHEMBL3119517 0.81 PTGS1 (0.53) CYP1A2CA1CA2
SCHEMBL29145894 0.79 CYP1A2 (0.61) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL9702187 0.78 CYP1A2 (0.52) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL411851 0.78 CYP1A2 (0.47) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL29349761 0.77 CYP1A2 (0.59) CYP1A2TRPV1TSHRNPC1RAB9A
SCHEMBL2273990 0.76 CA1 (0.54) CYP1A2CA1CA2
SCHEMBL2273994 0.76 CA1 (0.54) CYP1A2CA1CA2

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
CN-113717209-A Synthesis method of alkyl silicon compound 南通大学 2021-11-30 CN disclosed
CN-102344537-B Block copolymer and polymer composition prepared therefrom CHI MEI CORP 2014-04-16 CN disclosed
US-8598272-B2 Compatibilizer and blend polymer composition including the same CHI MEI CORPORATION (TW) 2013-12-03 US disclosed
CN-102344537-A Block copolymer and polymer composition prepared therefrom CHI MEI CORP 2012-02-08 CN disclosed
US-20120010363-A1 COMPATIBILIZER AND BLEND POLYMER COMPOSITION INCLUDING THE SAME CHI MEI CORPORATION (TW) 2012-01-12 US disclosed