Allylbenzene

Allylbenzene

SCHEMBL11093121

C=CCc1ccccc1.[BaH2]

nearest known ligand 0.57

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.57
▸ ALDH1A1 P00352 5/20 0.48
▸ TSHR P16473 4/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ CNR2 P34972 2/20 0.45
▸ XDH P47989 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ ARG2 P78540 1/20 0.43
▸ CALM1 P0DP23 1/20 0.43
▸ PPARG P37231 2/20 0.41
▸ PPARD Q03181 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH2 P05091 1/20 0.41
▸ GAA P10253 1/20 0.41

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
Allylbenzene SCHEMBL10325179 0.97 MAOB (0.60) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL21274 0.97 — —
Allylbenzene SCHEMBL2478260 0.97 MAOB (0.60) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL15282877 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL249313 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL11029677 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL9807340 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL972481 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL318129 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53
Allylbenzene SCHEMBL6528451 0.94 MAOB (0.57) MAOBALDH1A1TSHRSMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4464275-A MINERAL OIL WITH BARIUM SULFONATE, AMINE, AND ALCOHOL ADDITIVES KOYO SEIKO CO., LTD. (JP) 1984-08-07 — — US claimed
US-4293431-A OVERBASED COMPOUNDS; OIL ADDITIVES OROGIL (FR) 1981-10-06 — — US claimed
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