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Sugi Predict / Compounds / Styrene

Styrene

Styrene

SCHEMBL9577015

C=CC#N.C=CC=C.C=Cc1ccccc1.N#CC=CC#N

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.56
▸ TSHR P16473 3/20 0.56
▸ ENPP2 Q13822 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ MCL1 Q07820 1/20 0.31
▸ HDAC8 Q9BY41 2/20 0.31
▸ MAOB P27338 1/20 0.30
▸ CYP2A6 P11509 1/20 0.30

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
Styrene SCHEMBL28309652 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL27174987 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL6762043 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL5925794 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL7168838 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL15661 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL20377864 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL11458976 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL22411230 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1
Styrene SCHEMBL11206159 0.94 ALDH1A1 (0.64) ALDH1A1TSHRTP53TDP1MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5212240-A Fumaronitrile THE DOW CHEMICAL COMPANY (US) 1993-05-18 — — US disclosed